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(1S*,8R*,12R*)-2-Oxo-3-phenyltricyclo[6.3.1.0(4,12)]dodeca-3,10-diene
SpectraBase Compound ID DyndqkrZxSo
InChI InChI=1S/C18H18O/c19-18-15-11-5-9-12-8-4-10-14(16(12)15)17(18)13-6-2-1-3-7-13/h1-3,5-7,11-12,15-16H,4,8-10H2/t12-,15+,16+/m1/s1
InChIKey UMTPVFJXGWUNSH-KCXAZCMYSA-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 Iz1xFAKVYeJ
Name (1S*,8R*,12R*)-2-Oxo-3-phenyltricyclo[6.3.1.0(4,12)]dodeca-3,10-diene
Alternate Name(s) (5aR,8aS,8bR)-2-phenyl-4,5,5a,6,8a,8b-hexahydro-1(3H)-acenaphthylenone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18O
InChI InChI=1S/C18H18O/c19-18-15-11-5-9-12-8-4-10-14(16(12)15)17(18)13-6-2-1-3-7-13/h1-3,5-7,11-12,15-16H,4,8-10H2/t12-,15+,16+/m1/s1
InChIKey UMTPVFJXGWUNSH-KCXAZCMYSA-N
Molecular Weight 250.341 g/mol
SMILES C1(=C2[C@@]3([C@](CC=C[C@@]3(C1=O)[H])([H])CCC2)[H])c1ccccc1
SPLASH splash10-0v00-3890000000-f4e5f5e13a0f00cd0ed7
Source of Spectrum OV-23-798-9
Wiley ID 1577978