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3-Octenoic acid, butyl ester, (Z)-
SpectraBase Compound ID Fzi5mp8fUGM
InChI InChI=1S/C12H22O2/c1-3-5-7-8-9-10-12(13)14-11-6-4-2/h8-9H,3-7,10-11H2,1-2H3/b9-8-
InChIKey FXVJXUOWNYRTMM-HJWRWDBZSA-N
Mol Weight 198.31 g/mol
Molecular Formula C12H22O2
Exact Mass 198.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8yS4S3RoUSk
Name 3-Octenoic acid, butyl ester, (Z)-
CAS Registry Number 69668-86-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H22O2
InChI InChI=1S/C12H22O2/c1-3-5-7-8-9-10-12(13)14-11-6-4-2/h8-9H,3-7,10-11H2,1-2H3/b9-8-
InChIKey FXVJXUOWNYRTMM-HJWRWDBZSA-N
Molecular Weight 198.306 g/mol
SMILES CCCCOC(=O)C\C=C/CCCC
SPLASH splash10-0kbf-9100000000-4f3d41f045bbcd78cb47
Source of Spectrum XW-52-0-0
Synonyms Butyl (3Z)-3-octenoate (Z)-3-octenoic acid butyl ester (Z)-oct-3-enoic acid butyl ester Butyl (Z)-oct-3-enoate
Wiley ID 23009