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8a-methyl-1,2,3,3a,5,6,7,8-octahydroazulen-4-one
SpectraBase Compound ID HSiZrvqcial
InChI InChI=1S/C11H18O/c1-11-7-3-2-6-10(12)9(11)5-4-8-11/h9H,2-8H2,1H3
InChIKey NXZBFZHTKMMBPY-UHFFFAOYSA-N
Mol Weight 166.26 g/mol
Molecular Formula C11H18O
Exact Mass 166.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3MdjZcnyiig
Name 8a-methyl-1,2,3,3a,5,6,7,8-octahydroazulen-4-one
Alternate Name(s) 8a-Methyloctahydro-4(1H)-azulenone trans-8a-Methylperhydroazulen-4(1H)-one
CAS Registry Number 32166-45-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H18O
InChI InChI=1S/C11H18O/c1-11-7-3-2-6-10(12)9(11)5-4-8-11/h9H,2-8H2,1H3
InChIKey NXZBFZHTKMMBPY-UHFFFAOYSA-N
Molecular Weight 166.264 g/mol
SMILES C1C(C2CCCC2(CCC1)C)=O
SPLASH splash10-0a4i-6900000000-aa327307534910c1ad46
Source of Spectrum J-51-2415-4
Wiley ID 1163103