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cis-(2R*,8aS*)-2-Benzyl-3,8a-dihydro-8a-methylazulen-1(2H)-one
SpectraBase Compound ID GqZg5VebL2g
InChI InChI=1S/C18H18O/c1-18-11-7-3-6-10-16(18)13-15(17(18)19)12-14-8-4-2-5-9-14/h2-11,15H,12-13H2,1H3/t15-,18+/m1/s1
InChIKey VNXVHANCKRDFGE-QAPCUYQASA-N
Mol Weight 250.34 g/mol
Molecular Formula C18H18O
Exact Mass 250.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KANOfGGZDKv
Name cis-(2R*,8aS*)-2-Benzyl-3,8a-dihydro-8a-methylazulen-1(2H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18O
InChI InChI=1S/C18H18O/c1-18-11-7-3-6-10-16(18)13-15(17(18)19)12-14-8-4-2-5-9-14/h2-11,15H,12-13H2,1H3/t15-,18+/m1/s1
InChIKey VNXVHANCKRDFGE-QAPCUYQASA-N
Molecular Weight 250.341 g/mol
SMILES [C@]12(C(C[C@](C2=O)(Cc2ccccc2)[H])=CC=CC=C1)C
SPLASH splash10-00kf-9820000000-57225f6efd847e774f2b
Source of Spectrum F-70-6877-11g
Synonyms (2R,8aS)-2-benzyl-8a-methyl-2,3-dihydroazulen-1(8aH)-one
Wiley ID 1743170