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4-Pentenoic acid, 5-(acetyloxy)-5-cyano-4-methyl-, methyl ester, (Z)-
SpectraBase Compound ID ITvhGZyvMCg
InChI InChI=1S/C10H13NO4/c1-7(4-5-10(13)14-3)9(6-11)15-8(2)12/h4-5H2,1-3H3/b9-7-
InChIKey GDXWQXVQAOCBPB-CLFYSBASSA-N
Mol Weight 211.22 g/mol
Molecular Formula C10H13NO4
Exact Mass 211.084458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9KgRICLRnvw
Name 4-Pentenoic acid, 5-(acetyloxy)-5-cyano-4-methyl-, methyl ester, (Z)-
CAS Registry Number 62115-13-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H13NO4
InChI InChI=1S/C10H13NO4/c1-7(4-5-10(13)14-3)9(6-11)15-8(2)12/h4-5H2,1-3H3/b9-7-
InChIKey GDXWQXVQAOCBPB-CLFYSBASSA-N
Molecular Weight 211.217 g/mol
SMILES C(\C(OC(=O)C)=C\(CCC(=O)OC)C)#N
SPLASH splash10-0006-9100000000-054b6b75f5338f1b0013
Source of Spectrum C-99-186-0
Wiley ID 1210256