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2-Hepten-4-one, 6-hydroxy-2,5,5-trimethyl-
SpectraBase Compound ID BP8aSMrCeWa
InChI InChI=1S/C10H18O2/c1-7(2)6-9(12)10(4,5)8(3)11/h6,8,11H,1-5H3
InChIKey FVWOLBPEYJPKGP-UHFFFAOYSA-N
Mol Weight 170.25 g/mol
Molecular Formula C10H18O2
Exact Mass 170.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FJ0TTaMt9Qa
Name 2-Hepten-4-one, 6-hydroxy-2,5,5-trimethyl-
Alternate Name(s) 6-Hydroxy-2,5,5-trimethyl-2-hepten-4-one 6-Hydroxy-2,5,5-trimethylhept-2-en-4-one 2,5,5-trimethyl-6-oxidanyl-hept-2-en-4-one
CAS Registry Number 113793-74-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H18O2
InChI InChI=1S/C10H18O2/c1-7(2)6-9(12)10(4,5)8(3)11/h6,8,11H,1-5H3
InChIKey FVWOLBPEYJPKGP-UHFFFAOYSA-N
Molecular Weight 170.252 g/mol
SMILES OC(C(C(C=C(C)C)=O)(C)C)C
SPLASH splash10-0089-9000000000-54a46acfbcab995acd08
Source of Spectrum H-70-1751-21
Wiley ID 1167168