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2-Propenoic acid, 3-[(2,2,4-trimethyl-3-cyclohexen-1-yl)methoxy]-, methyl ester, (E)-(.+-.)-
SpectraBase Compound ID 1sOl3DFCmz0
InChI InChI=1S/C14H22O3/c1-11-5-6-12(14(2,3)9-11)10-17-8-7-13(15)16-4/h7-9,12H,5-6,10H2,1-4H3/b8-7+
InChIKey GTRWAQWKKKUGNL-BQYQJAHWSA-N
Mol Weight 238.33 g/mol
Molecular Formula C14H22O3
Exact Mass 238.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1FRJRJVnBwp
Name 2-Propenoic acid, 3-[(2,2,4-trimethyl-3-cyclohexen-1-yl)methoxy]-, methyl ester, (E)-(.+-.)-
CAS Registry Number 107890-58-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O3
InChI InChI=1S/C14H22O3/c1-11-5-6-12(14(2,3)9-11)10-17-8-7-13(15)16-4/h7-9,12H,5-6,10H2,1-4H3/b8-7+
InChIKey GTRWAQWKKKUGNL-BQYQJAHWSA-N
Molecular Weight 238.327 g/mol
SMILES C1(C=C(C)CCC1CO\C=C\C(=O)OC)(C)C
SPLASH splash10-00ed-9500000000-fbe58d046ac40679f2eb
Source of Spectrum J-52-2097-5
Synonyms Methyl (2E)-3-[(2,2,4-trimethyl-3-cyclohexen-1-yl)methoxy]-2-propenoate
Wiley ID 1240820