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(3E)-Hexenyl acetate
SpectraBase Compound ID BQE5nNw63S7
InChI InChI=1S/C8H14O2/c1-3-4-5-6-7-10-8(2)9/h4-5H,3,6-7H2,1-2H3/b5-4+
InChIKey NPFVOOAXDOBMCE-SNAWJCMRSA-N
Mol Weight 142.2 g/mol
Molecular Formula C8H14O2
Exact Mass 142.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gs825Sqcrt1
Name 3-Hexen-1-ol, acetate, (E)-
Alternate Name(s) (3E)-3-Hexenyl acetate (E)-3-Hexenyl acetate 3-Hexen-1-ol, acetate, (3E)- trans-3-Hexenyl acetate [(E)-hex-3-enyl] acetate [(E)-hex-3-enyl] ethanoate AI3-33358 EINECS 222-962-2
CAS Registry Number 3681-82-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H14O2
InChI InChI=1S/C8H14O2/c1-3-4-5-6-7-10-8(2)9/h4-5H,3,6-7H2,1-2H3/b5-4+
InChIKey NPFVOOAXDOBMCE-SNAWJCMRSA-N
Molecular Weight 142.198 g/mol
SMILES CC\C=C\CCOC(=O)C
SPLASH splash10-0006-9000000000-6554a495484fa9df06f2
Source of Spectrum XW-186-0-0
Wiley ID 1141050