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(E)-Hex-1-enyl 3-methylbenzoate
SpectraBase Compound ID C2NbrBlZ8uT
InChI InChI=1S/C14H18O2/c1-3-4-5-6-10-16-14(15)13-9-7-8-12(2)11-13/h6-11H,3-5H2,1-2H3/b10-6+
InChIKey TYTVHHNSDNTWEL-UXBLZVDNSA-N
Mol Weight 218.3 g/mol
Molecular Formula C14H18O2
Exact Mass 218.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C3vcNA3jUJn
Name (E)-Hex-1-enyl 3-methylbenzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O2
InChI InChI=1S/C14H18O2/c1-3-4-5-6-10-16-14(15)13-9-7-8-12(2)11-13/h6-11H,3-5H2,1-2H3/b10-6+
InChIKey TYTVHHNSDNTWEL-UXBLZVDNSA-N
Literature Reference DOI 10.1021/ol4013712
Molecular Weight 218.296 g/mol
SMILES CCCC\C=C\OC(c1cccc(c1)C)=O
SPLASH splash10-014i-3900000000-e73ac567dc7227ac826f
Source of Spectrum A1-15-3150/SMS6-1f
Synonyms (E)-hex-1-en-1-yl 3-methylbenzoate
Wiley ID 1748813