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5H-Dibenzo[a,d]cyclohepten-5-one, 1,4,4a,10,11,11a-hexahydro-2-methyl-, trans-
SpectraBase Compound ID EZJYtsAyS4T
InChI InChI=1S/C16H18O/c1-11-6-9-15-13(10-11)8-7-12-4-2-3-5-14(12)16(15)17/h2-6,13,15H,7-10H2,1H3/t13-,15-/m0/s1
InChIKey IMCRIUYZADBIRO-ZFWWWQNUSA-N
Mol Weight 226.32 g/mol
Molecular Formula C16H18O
Exact Mass 226.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ALWqavCrpbc
Name 5H-Dibenzo[a,d]cyclohepten-5-one, 1,4,4a,10,11,11a-hexahydro-2-methyl-, trans-
Alternate Name(s) (4aS,11aS)-2-methyl-1,4,4a,10,11,11a-hexahydro-5H-dibenzo[a,d]cyclohepten-5-one 8-Methyl(benzo[c]bicylo[5.4.0]undec)-11-one
CAS Registry Number 102710-66-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18O
InChI InChI=1S/C16H18O/c1-11-6-9-15-13(10-11)8-7-12-4-2-3-5-14(12)16(15)17/h2-6,13,15H,7-10H2,1H3/t13-,15-/m0/s1
InChIKey IMCRIUYZADBIRO-ZFWWWQNUSA-N
Molecular Weight 226.319 g/mol
SMILES C1([C@@]2([C@](CC(=CC2)C)(CCc2c1cccc2)[H])[H])=O
SPLASH splash10-00mo-3910000000-b0e9f630f994573d9d96
Source of Spectrum F-44-6238-9
Wiley ID 1228217