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6-(5-keto-6,7,8,9-tetrahydrobenzocyclohepten-6-yl)-6,7,8,9-tetrahydrobenzocyclohepten-5-one
SpectraBase Compound ID IwCRREqGwv7
InChI InChI=1S/C22H22O2/c23-21-17-11-3-1-7-15(17)9-5-13-19(21)20-14-6-10-16-8-2-4-12-18(16)22(20)24/h1-4,7-8,11-12,19-20H,5-6,9-10,13-14H2
InChIKey WMADXNIPIDDPKS-UHFFFAOYSA-N
Mol Weight 318.42 g/mol
Molecular Formula C22H22O2
Exact Mass 318.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5CvJGU9dl9w
Name 6-(5-keto-6,7,8,9-tetrahydrobenzocyclohepten-6-yl)-6,7,8,9-tetrahydrobenzocyclohepten-5-one
Alternate Name(s) 6-(5-oxidanylidene-6,7,8,9-tetrahydrobenzo[7]annulen-6-yl)-6,7,8,9-tetrahydrobenzo[7]annulen-5-one 6-(5-oxo-6,7,8,9-tetrahydrobenzo[7]annulen-6-yl)-6,7,8,9-tetrahydrobenzo[7]annulen-5-one
CAS Registry Number 81096-53-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H22O2
InChI InChI=1S/C22H22O2/c23-21-17-11-3-1-7-15(17)9-5-13-19(21)20-14-6-10-16-8-2-4-12-18(16)22(20)24/h1-4,7-8,11-12,19-20H,5-6,9-10,13-14H2
InChIKey WMADXNIPIDDPKS-UHFFFAOYSA-N
Molecular Weight 318.416 g/mol
SMILES C1(C(C2C(c3c(cccc3)CCC2)=O)CCCc2c1cccc2)=O
SPLASH splash10-0aos-9503000000-854f862d64c7ea360158
Source of Spectrum J-47-1883-0
Wiley ID 1319048