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2,5-Heptadien-1-ol, 6-methoxy-3-methyl-, acetate
SpectraBase Compound ID 23ydVmoxmvr
InChI InChI=1S/C11H18O3/c1-9(5-6-10(2)13-4)7-8-14-11(3)12/h6-7H,5,8H2,1-4H3/b9-7+,10-6+
InChIKey ZGDAPJXZJZLEFQ-IDXDHNASSA-N
Mol Weight 198.26 g/mol
Molecular Formula C11H18O3
Exact Mass 198.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LiMVtwwgAoH
Name 2,5-Heptadien-1-ol, 6-methoxy-3-methyl-, acetate
Alternate Name(s) (2E,5E)-6-methoxy-3-methyl-2,5-heptadienyl acetate
CAS Registry Number 55402-27-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H18O3
InChI InChI=1S/C11H18O3/c1-9(5-6-10(2)13-4)7-8-14-11(3)12/h6-7H,5,8H2,1-4H3/b9-7+,10-6+
InChIKey ZGDAPJXZJZLEFQ-IDXDHNASSA-N
Molecular Weight 198.262 g/mol
SMILES CO\C(=C\C\C(=C\COC(=O)C)C)C
SPLASH splash10-0006-9100000000-85d8d1d5e8f7fae3f6a8
Source of Spectrum SD-1981-0-0
Wiley ID 1195467