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cis-(2R*,8aS*)-3,8a-Dihydro-2-phenyl-8a-methylazulen-1(2H)-one
SpectraBase Compound ID KZXsUW2Stlu
InChI InChI=1S/C17H16O/c1-17-11-7-3-6-10-14(17)12-15(16(17)18)13-8-4-2-5-9-13/h2-11,15H,12H2,1H3/t15-,17+/m1/s1
InChIKey XOBAVZVNNCALDY-WBVHZDCISA-N
Mol Weight 236.31 g/mol
Molecular Formula C17H16O
Exact Mass 236.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AiyhiTkh3Wv
Name cis-(2R*,8aS*)-3,8a-Dihydro-2-phenyl-8a-methylazulen-1(2H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16O
InChI InChI=1S/C17H16O/c1-17-11-7-3-6-10-14(17)12-15(16(17)18)13-8-4-2-5-9-13/h2-11,15H,12H2,1H3/t15-,17+/m1/s1
InChIKey XOBAVZVNNCALDY-WBVHZDCISA-N
Molecular Weight 236.314 g/mol
SMILES [C@]12(C([C@@](c3ccccc3)(CC1=CC=CC=C2)[H])=O)C
SPLASH splash10-0f76-9650000000-c7f50008c324cd9ac08f
Source of Spectrum F-70-6877-11f
Synonyms (2R,8aS)-8a-methyl-2-phenyl-2,3-dihydroazulen-1(8aH)-one
Wiley ID 1743171