9-Octadecenoic acid, 12-[(phenylacetyl)amino]-, methyl ester, (Z)-

SpectraBase Compound ID	5XNpp4iWmSG
InChI	InChI=1S/C27H43NO3/c1-3-4-5-15-20-25(28-26(29)23-24-18-13-12-14-19-24)21-16-10-8-6-7-9-11-17-22-27(30)31-2/h10,12-14,16,18-19,25H,3-9,11,15,17,20-23H2,1-2H3,(H,28,29)/b16-10-
InChIKey	PATXROFWONTVFW-YBEGLDIGSA-N Google Search
Mol Weight	429.6 g/mol
Molecular Formula	C27H43NO3
Exact Mass	429.324294 g/mol

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SpectraBase Spectrum ID	B0I2xVZsjvU
Name	9-Octadecenoic acid, 12-[(phenylacetyl)amino]-, methyl ester, (Z)-
Alternate Name(s)	Methyl (9Z)-12-[(phenylacetyl)amino]-9-octadecenoate Methyl 12-benzylcarbonylamino-octadeca-9-enoate
CAS Registry Number	120783-77-9
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C27H43NO3
InChI	InChI=1S/C27H43NO3/c1-3-4-5-15-20-25(28-26(29)23-24-18-13-12-14-19-24)21-16-10-8-6-7-9-11-17-22-27(30)31-2/h10,12-14,16,18-19,25H,3-9,11,15,17,20-23H2,1-2H3,(H,28,29)/b16-10-
InChIKey	PATXROFWONTVFW-YBEGLDIGSA-N
Molecular Weight	429.645 g/mol
SMILES	N(C(=O)Cc1ccccc1)C(C\C=C/CCCCCCCC(=O)OC)CCCCCC
SPLASH	splash10-03e9-0950000000-cd2a429169b645dd0a99
Source of Spectrum	KC-1989-5-1
Wiley ID	1381242