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Sabina ketone <dehydro->
SpectraBase Compound ID 1WOSBPjssCP
InChI InChI=1S/C9H12O/c1-6(2)9-4-3-8(10)7(9)5-9/h3-4,6-7H,5H2,1-2H3
InChIKey IBMZINAPWMATGM-UHFFFAOYSA-N
Mol Weight 136.19 g/mol
Molecular Formula C9H12O
Exact Mass 136.088815 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LqoLeNpb7DG
Name Dehydrosabinaketone
CAS Registry Number 36262-12-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 ??m film thickness)
GC Oven Program 60 ??C to 246 ??C at 3 ??C/min.
InChI InChI=1S/C9H12O/c1-6(2)9-4-3-8(10)7(9)5-9/h3-4,6-7H,5H2,1-2H3
InChIKey IBMZINAPWMATGM-UHFFFAOYSA-N
Molecular Weight 136.194 g/mol
SMILES CC(C)C12C(C(=O)C=C2)C1
SPLASH splash10-0006-9100000000-00f5c77c998bd4442a5c
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Synonyms Sabina ketone
Wiley ID 1887811