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3-Butenoic acid, 4-(1-cyclohexen-1-yl)-, methyl ester, (E)-
SpectraBase Compound ID BtQcAVPW0i8
InChI InChI=1S/C11H16O2/c1-13-11(12)9-5-8-10-6-3-2-4-7-10/h5-6,8H,2-4,7,9H2,1H3/b8-5+
InChIKey JRCZYQLTAATNPB-VMPITWQZSA-N
Mol Weight 180.25 g/mol
Molecular Formula C11H16O2
Exact Mass 180.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DlwL0UR458e
Name 3-Butenoic acid, 4-(1-cyclohexen-1-yl)-, methyl ester, (E)-
CAS Registry Number 103344-57-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16O2
InChI InChI=1S/C11H16O2/c1-13-11(12)9-5-8-10-6-3-2-4-7-10/h5-6,8H,2-4,7,9H2,1H3/b8-5+
InChIKey JRCZYQLTAATNPB-VMPITWQZSA-N
Molecular Weight 180.247 g/mol
SMILES C1(\C=C\CC(=O)OC)=CCCCC1
SPLASH splash10-004l-9600000000-9edbe00247023f8047eb
Source of Spectrum I-64-463-26
Synonyms 1-(3-Methoxycarbonyl-1-propenyl)-1-cyclohexene Methyl (3E)-4-(1-cyclohexen-1-yl)-3-butenoate
Wiley ID 1176566