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3-Pentenoic acid, 2,4-dimethyl-, cyclohexylmethyl ester, (S)-
SpectraBase Compound ID KVuRoepMQQF
InChI InChI=1S/C14H24O2/c1-11(2)9-12(3)14(15)16-10-13-7-5-4-6-8-13/h9,12-13H,4-8,10H2,1-3H3/t12-/m0/s1
InChIKey XJVDOVQYYKTHMS-LBPRGKRZSA-N
Mol Weight 224.34 g/mol
Molecular Formula C14H24O2
Exact Mass 224.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3F5HGCfiXjd
Name 3-Pentenoic acid, 2,4-dimethyl-, cyclohexylmethyl ester, (S)-
Alternate Name(s) cyclohexylmethyl (2S)-2,4-dimethyl-3-pentenoate Cyclohexylmethyl 2,4-dimethyl-3-pentenoate
CAS Registry Number 108584-81-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H24O2
InChI InChI=1S/C14H24O2/c1-11(2)9-12(3)14(15)16-10-13-7-5-4-6-8-13/h9,12-13H,4-8,10H2,1-3H3/t12-/m0/s1
InChIKey XJVDOVQYYKTHMS-LBPRGKRZSA-N
Molecular Weight 224.344 g/mol
SMILES C([C@](C=C(C)C)(C)[H])(OCC1CCCCC1)=O
SPLASH splash10-053r-9000000000-51986d65b6f3e31529d9
Source of Spectrum F-45-6189-23
Wiley ID 1225636