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1-Hepten-4-one, 6-hydroxy-2,5,5-trimethyl-
SpectraBase Compound ID 6JF0VgBcH6W
InChI InChI=1S/C10H18O2/c1-7(2)6-9(12)10(4,5)8(3)11/h8,11H,1,6H2,2-5H3
InChIKey GRTLEMOYXJOOQJ-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 3Fqn9KMbyfK
Name 1-Hepten-4-one, 6-hydroxy-2,5,5-trimethyl-
Alternate Name(s) 6-Hydroxy-2,2,5-trimethyl-1-hepten-4-one 6-Hydroxy-2,5,5-trimethyl-1-hepten-4-one
CAS Registry Number 113793-73-0
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/h8,11H,1,6H2,2-5H3
InChIKey GRTLEMOYXJOOQJ-UHFFFAOYSA-N
Molecular Weight 170.252 g/mol
SMILES OC(C(C(CC(=C)C)=O)(C)C)C
SPLASH splash10-00ri-9100000000-76e4407527a73ba099a8
Source of Spectrum H-70-1751-20
Wiley ID 1167167