Peak Info.

Sesame seeds, whole, dried and roasted (black)

pos

Peak #7884 MN MID: SE113_S050182_M90

m/z: 342.33685, RT: 101.67, Int: 1987, log(Int.): -0.05, Adduct: [M+C2H7N+IsoProp-H2O+H]+, #Sample shared: 2

DB search result: (41 names) 5Z-hexadecenoic acid;14-methyl-6Z-pentadecenoic acid;ethyl 7E-tetradecenoate;16-Hexadecanolide;14-methyl-9E-pentadecenoic acid;ethyl 9E-tetradecenoate;5-Dodecyldihydro-2(3H)-furanone;10-hexadecenoic a...

Number of candidates found in each DB: ALL 41 KG 2 KN 5 HM 3 LM 31

FlavonoidSearch top score MS2: -, MS3: -

Formula	MW	delta ppm	Candidate name (Shortest name is shown as representative)	Compound IDs
C16H30O2	254.22458	0.748	(Z)-5-Hexadecenoic acid	HMDB: HMDB0032638 LipidMAPS: LMFA01030854, LMFA01031290
C16H30O2	254.22458	0.748	(Z)-14-Methyl-6-pentadecenoic acid	HMDB: HMDB0041422 LipidMAPS: LMFA01020440
C16H30O2	254.22458	0.748	ethyl 7E-tetradecenoate	LipidMAPS: LMFA07010491
C16H30O2	254.22458	0.748	Dihydroambrettolide	KNApSAcK: C00054115 LipidMAPS: LMFA07040054
C16H30O2	254.22458	0.748	14-methyl-9E-pentadecenoic acid	LipidMAPS: LMFA01031198
C16H30O2	254.22458	0.748	ethyl 9E-tetradecenoate	LipidMAPS: LMFA07010492, LMFA07010494
C16H30O2	254.22458	0.748	5-Dodecyldihydro-2(3H)-furanone	HMDB: HMDB0031145
C16H30O2	254.22458	0.748	10Z-hexadecenoic acid	LipidMAPS: LMFA01030058, LMFA01030260
C16H30O2	254.22458	0.748	8E-Tetradecenyl acetate	LipidMAPS: LMFA07010291, LMFA07010315
C16H30O2	254.22458	0.748	11E-Tetradecenyl acetate	LipidMAPS: LMFA07010285, LMFA07010309
C16H30O2	254.22458	0.748	5-Hexadecanolide	LipidMAPS: LMFA07040055
C16H30O2	254.22458	0.748	12E-Tetradecenyl acetate	LipidMAPS: LMFA07010286, LMFA07010310
C16H30O2	254.22458	0.748	4Z-hexadecenoic acid	LipidMAPS: LMFA01030894, LMFA01031291
C16H30O2	254.22458	0.748	11-Hexadecenoic acid	HMDB: HMDB0037647 KNApSAcK: C00052540 LipidMAPS: LMFA01030261, LMFA01030262
C16H30O2	254.22458	0.748	(Z)-13-Hexadecenoic acid	HMDB: HMDB0035877 LipidMAPS: LMFA01030263, LMFA01030264
C16H30O2	254.22458	0.748	(9Z)-Hexadecenoic acid	HMDB: HMDB0003229, HMDB0012328, HMDB0247596 KEGG: C08362 KNApSAcK: C00001234, C00029354, C00052377, C00053310 LipidMAPS: LMFA01030056, LMFA01030057
C16H30O2	254.22458	0.748	15-Hexadecenoic acid	HMDB: HMDB0244666
C16H30O2	254.22458	0.748	Citronellyl hexanoate	HMDB: HMDB0038958 LipidMAPS: LMFA07010816
C16H30O2	254.22458	0.748	Hexadec-8-enoic acid	KNApSAcK: C00053309 LipidMAPS: LMFA01031081, LMFA01031190
C16H30O2	254.22458	0.748	13-methyl-4-pentadecenoic acid	LipidMAPS: LMFA01030893
C16H30O2	254.22458	0.748	6E-Tetradecenyl acetate	LipidMAPS: LMFA07010289, LMFA07010313
C16H30O2	254.22458	0.748	9E-Tetradecenyl acetate	LipidMAPS: LMFA07010293, LMFA07010316
C16H30O2	254.22458	0.748	Vittatalactone	KNApSAcK: C00043115 LipidMAPS: LMFA07040032
C16H30O2	254.22458	0.748	6,7-methylene-pentadecanoic acid	LipidMAPS: LMFA01140044
C16H30O2	254.22458	0.748	2,4-dimethyl-2E-tetradecenoic acid	LipidMAPS: LMFA01020133
C16H30O2	254.22458	0.748	14Z-hexadecenoic acid	LipidMAPS: LMFA01031288, LMFA01031289
C16H30O2	254.22458	0.748	Dodecyl methacrylate	HMDB: HMDB0251570
C16H30O2	254.22458	0.748	6-isopentyl-9-methyl-5-decenoic acid	LipidMAPS: LMFA01020142
C16H30O2	254.22458	0.748	7E-Tetradecenyl acetate	LipidMAPS: LMFA07010290, LMFA07010314
C16H30O2	254.22458	0.748	(E)-3-Hexadecenoic acid	HMDB: HMDB0033791 LipidMAPS: LMFA01030266
C16H30O2	254.22458	0.748	(Z)-7-Dodecenyl butyrate	LipidMAPS: LMFA07010537
C16H30O2	254.22458	0.748	Trans-Hexa-dec-2-enoic acid	HMDB: HMDB0010735 LipidMAPS: LMFA01030054, LMFA01030265
C16H30O2	254.22458	0.748	15-Hexadecanolide	HMDB: HMDB0031711 LipidMAPS: LMFA07040052
C16H30O2	254.22458	0.748	Sapienic acid	HMDB: HMDB0031053, HMDB0257483 KEGG: C21942 LipidMAPS: LMFA01030267, LMFA01031082
C16H30O2	254.22458	0.748	omega-Cycloheptanenonanoic acid	KNApSAcK: C00000350 LipidMAPS: LMFA01140096
C16H30O2	254.22458	0.748	5E-Tetradecenyl acetate	LipidMAPS: LMFA07010288, LMFA07010312
C16H30O2	254.22458	0.748	10E-Tetradecenyl acetate	LipidMAPS: LMFA07010283, LMFA07010307
C16H30O2	254.22458	0.748	2-hexyl-2-decenoic acid	LipidMAPS: LMFA01020141
C16H30O2	254.22458	0.748	dodecyl 2E-butenoate	LipidMAPS: LMFA07010515
C16H30O2	254.22458	0.748	Hypogeic acid	HMDB: HMDB0002186 LipidMAPS: LMFA01030055, LMFA01030808
C16H30O2	254.22458	0.748	3E-Tetradecenyl acetate	LipidMAPS: LMFA07010287, LMFA07010311
C16H30O2	254.22458	0.748	14-methyl-4-pentadecenoic acid	LipidMAPS: LMFA01020140
C16H30O2	254.22458	0.748	12Z-hexadecenoic acid	LipidMAPS: LMFA01031280, LMFA01031281

MSn Spectra

Level: 2, Precursor m/z: 342.33676

Splash: splash10-00di-0009000000-3246c7ad9da0a57285be

m/z	Int.	NL	Rel. Int.
324.39	8107	18	1000

Related Peaks

Peak No.	RT (min)	m/z	delta mass	Int. (log)	Adduct	DB Search Results	#Cand.	MSn	FS2	FS3	#Sample shared
7884	101.67	342.33685	0.0000	-0.05	[M+C2H7N+IsoProp-H2O+H]+	(41 names) 5Z-hexadecenoic acid; 14-methyl-6Z-pentadecenoic acid; ethyl 7E-tetradecenoate; 16-Hexadecanolide; 14-methyl-9E-pentadecenoic acid; ethyl 9E-tetradecenoate; 5-Dodecyldihydro-2(3H)-furanone; 10-hexadecenoic a...	ALL 41 KG 2 KN 5 HM 3 LM 31	MS2			2
	101.64	328.28480	-14.0520	0.66	[M+ACN+CH3OH+H]+	(41 names) 5Z-hexadecenoic acid; 14-methyl-6Z-pentadecenoic acid; ethyl 7E-tetradecenoate; 16-Hexadecanolide; 14-methyl-9E-pentadecenoic acid; ethyl 9E-tetradecenoate; 5-Dodecyldihydro-2(3H)-furanone; 10-hexadecenoic a...	ALL 41 KG 2 KN 5 HM 3 LM 31	MS2 MS3 x 2			14
	102.09	300.28995	-42.0469	1.43	[M+C2H7N+H]+	(41 names) 5Z-hexadecenoic acid; 14-methyl-6Z-pentadecenoic acid; ethyl 7E-tetradecenoate; 16-Hexadecanolide; 14-methyl-9E-pentadecenoic acid; ethyl 9E-tetradecenoate; 5-Dodecyldihydro-2(3H)-furanone; 10-hexadecenoic a...	ALL 41 KG 2 KN 5 HM 3 LM 31	MS2 MS3		0.049	63
	102.17	296.25864	-46.0782	0.96	[M+ACN+H]+	(41 names) 5Z-hexadecenoic acid; 14-methyl-6Z-pentadecenoic acid; ethyl 7E-tetradecenoate; 16-Hexadecanolide; 14-methyl-9E-pentadecenoic acid; ethyl 9E-tetradecenoate; 5-Dodecyldihydro-2(3H)-furanone; 10-hexadecenoic a...	ALL 41 KG 2 KN 5 HM 3 LM 31				19
	101.40	287.25826	-55.0786	0.49	[M+CH3OH+H]+	(41 names) 5Z-hexadecenoic acid; 14-methyl-6Z-pentadecenoic acid; ethyl 7E-tetradecenoate; 16-Hexadecanolide; 14-methyl-9E-pentadecenoic acid; ethyl 9E-tetradecenoate; 5-Dodecyldihydro-2(3H)-furanone; 10-hexadecenoic a...	ALL 41 KG 2 KN 5 HM 3 LM 31	MS2 MS3	0.250		9
	101.41	269.24767	-73.0892	-0.40	[M+CH3OH-H2O+H]+	(41 names) 5Z-hexadecenoic acid; 14-methyl-6Z-pentadecenoic acid; ethyl 7E-tetradecenoate; 16-Hexadecanolide; 14-methyl-9E-pentadecenoic acid; ethyl 9E-tetradecenoate; 5-Dodecyldihydro-2(3H)-furanone; 10-hexadecenoic a...	ALL 41 KG 2 KN 5 HM 3 LM 31	MS2 MS3 x 2	0.067		5
	102.17	255.23208	-87.1048	1.42	[M+H]+	(41 names) 5Z-hexadecenoic acid; 14-methyl-6Z-pentadecenoic acid; ethyl 7E-tetradecenoate; 16-Hexadecanolide; 14-methyl-9E-pentadecenoic acid; ethyl 9E-tetradecenoate; 5-Dodecyldihydro-2(3H)-furanone; 10-hexadecenoic a...	ALL 41 KG 2 KN 5 HM 3 LM 31	MS2 MS3 x 2	0.286		28

Peak Information

DB Search Results

MSn Spectra

FlavonoidSearch Results

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