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(E)-3-[(1R,5S)-2,5,6,6-tetramethyl-1-cyclohex-2-enyl]-2-propenoic acid
SpectraBase Compound ID CsAeEbG4Fit
InChI InChI=1S/C13H20O2/c1-9-5-6-10(2)13(3,4)11(9)7-8-12(14)15/h5,7-8,10-11H,6H2,1-4H3,(H,14,15)/b8-7+/t10-,11+/m0/s1
InChIKey YXIOQOCNYUYLMR-IAYMVZNDSA-N
Mol Weight 208.3 g/mol
Molecular Formula C13H20O2
Exact Mass 208.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JKSflYBBCbK
Name (E)-3-[(1R,5S)-2,5,6,6-tetramethyl-1-cyclohex-2-enyl]-2-propenoic acid
Alternate Name(s) (E)-3-[(1R,5S)-2,5,6,6-tetramethylcyclohex-2-en-1-yl]acrylic acid (E)-3-[(1R,5S)-2,5,6,6-tetramethylcyclohex-2-en-1-yl]prop-2-enoic acid
CAS Registry Number 107890-64-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O2
InChI InChI=1S/C13H20O2/c1-9-5-6-10(2)13(3,4)11(9)7-8-12(14)15/h5,7-8,10-11H,6H2,1-4H3,(H,14,15)/b8-7+/t10-,11+/m0/s1
InChIKey YXIOQOCNYUYLMR-IAYMVZNDSA-N
Molecular Weight 208.301 g/mol
SMILES OC(\C=C\[C@]1(C([C@@](C)(CC=C1C)[H])(C)C)[H])=O
SPLASH splash10-0006-9400000000-886fcfbd4ad49083eae8
Source of Spectrum J-52-2098-10
Wiley ID 1207261