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(E,E)-1-[(S)-2'-Methoxy-2'-phenylacetoxy]-1,3-hexadiene
SpectraBase Compound ID BIofZphuRD0
InChI InChI=1S/C15H18O3/c1-3-4-5-9-12-18-15(16)14(17-2)13-10-7-6-8-11-13/h4-12,14H,3H2,1-2H3/b5-4+,12-9+/t14-/m0/s1
InChIKey BCFPBYHHPMSBAE-SGWLKSDUSA-N
Mol Weight 246.31 g/mol
Molecular Formula C15H18O3
Exact Mass 246.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KFHsKnAiTYm
Name (E,E)-1-[(S)-2'-Methoxy-2'-phenylacetoxy]-1,3-hexadiene
Alternate Name(s) (1E,3E)-1,3-hexadienyl (2S)-methoxy(phenyl)ethanoate
CAS Registry Number 67177-15-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18O3
InChI InChI=1S/C15H18O3/c1-3-4-5-9-12-18-15(16)14(17-2)13-10-7-6-8-11-13/h4-12,14H,3H2,1-2H3/b5-4+,12-9+/t14-/m0/s1
InChIKey BCFPBYHHPMSBAE-SGWLKSDUSA-N
Molecular Weight 246.306 g/mol
SMILES C([C@](c1ccccc1)(OC)[H])(=O)O\C=C\C=C\CC
SPLASH splash10-00di-2900000000-be5a1e74d07a32f34038
Source of Spectrum J-43-4563-0
Wiley ID 1249144