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anti-10-hydroxy-5,6,8,9-tetrahydro-5,9-methano-7H-benzocyclohepten-7-one
SpectraBase Compound ID AdjDxvsh9it
InChI InChI=1S/C12H12O2/c13-7-5-10-8-3-1-2-4-9(8)11(6-7)12(10)14/h1-4,10-12,14H,5-6H2
InChIKey WTUJGDNXIGMCSU-UHFFFAOYSA-N
Mol Weight 188.23 g/mol
Molecular Formula C12H12O2
Exact Mass 188.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BUQTFvqA8rx
Name anti-10-hydroxy-5,6,8,9-tetrahydro-5,9-methano-7H-benzocyclohepten-7-one
Alternate Name(s) 12-hydroxytricyclo[6.3.1.0(2,7)]dodeca-2,4,6-trien-10-one
CAS Registry Number 55139-53-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12O2
InChI InChI=1S/C12H12O2/c13-7-5-10-8-3-1-2-4-9(8)11(6-7)12(10)14/h1-4,10-12,14H,5-6H2
InChIKey WTUJGDNXIGMCSU-UHFFFAOYSA-N
Molecular Weight 188.226 g/mol
SMILES OC1C2c3c(C1CC(C2)=O)cccc3
SPLASH splash10-00p0-0900000000-8ce7e0ea7a37b57f2cc3
Source of Spectrum J-55-1670-14
Wiley ID 1184926