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1,5-Heptadiene-3,4-diol, 2,5-dimethyl-
SpectraBase Compound ID 1D5Bjx9Pbi3
InChI InChI=1S/C9H16O2/c1-5-7(4)9(11)8(10)6(2)3/h5,8-11H,2H2,1,3-4H3/b7-5+
InChIKey ICLPTTARVKZAKL-FNORWQNLSA-N
Mol Weight 156.22 g/mol
Molecular Formula C9H16O2
Exact Mass 156.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JlP8KVQfEGF
Name 1,5-Heptadiene-3,4-diol, 2,5-dimethyl-
Alternate Name(s) (5E)-2,5-Dimethyl-1,5-heptadiene-3,4-diol (5E)-2,5-dimethylhepta-1,5-diene-3,4-diol
CAS Registry Number 22607-16-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H16O2
InChI InChI=1S/C9H16O2/c1-5-7(4)9(11)8(10)6(2)3/h5,8-11H,2H2,1,3-4H3/b7-5+
InChIKey ICLPTTARVKZAKL-FNORWQNLSA-N
Molecular Weight 156.225 g/mol
SMILES OC(C(O)C(C)=C)\C(=C\C)C
SPLASH splash10-007c-9000000000-dc95e3161be260163ec8
Source of Spectrum SD-1981-0-0
Wiley ID 1153675