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2,4-Hexadiene-1,6-diol, 3-methyl-, 1-acetate, (E,E)-
SpectraBase Compound ID 9YFPGnYbCC6
InChI InChI=1S/C9H14O3/c1-8(4-3-6-10)5-7-12-9(2)11/h3-5,10H,6-7H2,1-2H3/b4-3+,8-5+
InChIKey PEYZSOGWHHENHH-SALQQRKASA-N
Mol Weight 170.21 g/mol
Molecular Formula C9H14O3
Exact Mass 170.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KmR7RpneYnV
Name 2,4-Hexadiene-1,6-diol, 3-methyl-, 1-acetate, (E,E)-
CAS Registry Number 59385-07-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H14O3
InChI InChI=1S/C9H14O3/c1-8(4-3-6-10)5-7-12-9(2)11/h3-5,10H,6-7H2,1-2H3/b4-3+,8-5+
InChIKey PEYZSOGWHHENHH-SALQQRKASA-N
Molecular Weight 170.208 g/mol
SMILES OC\C=C\C(=C\COC(=O)C)C
SPLASH splash10-000f-9100000000-f1f21ccb40d0a5f07ebd
Source of Spectrum H-59-402-9
Synonyms (2E,4E)-6-hydroxy-3-methyl-2,4-hexadienyl acetate all-E-6-hydroxy-3-methyl-2,4-hexadienyl-acetate Acetic acid [(2E,4E)-6-hydroxy-3-methylhexa-2,4-dienyl] ester [(2E,4E)-6-hydroxy-3-methylhexa-2,4-dienyl] acetate [(2E,4E)-6-hydroxy-3-methyl-hexa-2,4-dienyl] acetate [(2E,4E)-3-methyl-6-oxidanyl-hexa-2,4-dienyl] ethanoate
Wiley ID 1166520