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2-Butenoic acid, 3-(4-methyl-3-cyclohexen-1-yl)-, [R-(E)]-
SpectraBase Compound ID 6f184dzOIfM
InChI InChI=1S/C11H16O2/c1-8-3-5-10(6-4-8)9(2)7-11(12)13/h3,7,10H,4-6H2,1-2H3,(H,12,13)/b9-7+/t10-/m0/s1
InChIKey KENWRRUSJKMXOL-PCYYEKQGSA-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 CNFGsq27Ddz
Name 2-Butenoic acid, 3-(4-methyl-3-cyclohexen-1-yl)-, [R-(E)]-
CAS Registry Number 51373-21-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16O2
InChI InChI=1S/C11H16O2/c1-8-3-5-10(6-4-8)9(2)7-11(12)13/h3,7,10H,4-6H2,1-2H3,(H,12,13)/b9-7+/t10-/m0/s1
InChIKey KENWRRUSJKMXOL-PCYYEKQGSA-N
Molecular Weight 180.247 g/mol
SMILES OC(\C=C\([C@]1(CC=C(CC1)C)[H])C)=O
SPLASH splash10-01sm-4900000000-cdbca84ef59f1c7fe14b
Source of Spectrum F-34-602-0
Synonyms (2E)-3-[(1R)-4-methyl-3-cyclohexen-1-yl]-2-butenoic acid Limonenecarboxylic acid
Wiley ID 1176446