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KWHUHTFXMNQHAA-UHFFFAOYSA-N
SpectraBase Compound ID EiWp4RXPWje
InChI InChI=1S/C11H12O/c12-11-8-4-2-6-9-5-1-3-7-10(9)11/h1,3,5,7H,2,4,6,8H2
InChIKey KWHUHTFXMNQHAA-UHFFFAOYSA-N
Mol Weight 160.22 g/mol
Molecular Formula C11H12O
Exact Mass 160.088815 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KW7mREASDDd
Name 5H-Benzocyclohepten-5-one, 6,7,8,9-tetrahydro-
Alternate Name(s) .alpha.-Benzosuberone 1-Benzosuberanone 1-Benzosuberone 2,3-Benzosuberone 5-Benzocycloheptanone 6,7,8,9-Tetrahydro-5H-benzo[a]cyclohepten-5-one 6,7,8,9-Tetrahydrobenzobicyclohepten-5-one 6,7,8,9-Tetrahydrobenzocyclohepten-5-one 6,7,8,9-tetrahydrobenzo[7]annulen-5-one Benzosuberone Benzo[b]cycloheptan-1-one Benzsuberone
CAS Registry Number 826-73-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12O
InChI InChI=1S/C11H12O/c12-11-8-4-2-6-9-5-1-3-7-10(9)11/h1,3,5,7H,2,4,6,8H2
InChIKey KWHUHTFXMNQHAA-UHFFFAOYSA-N
Molecular Weight 160.216 g/mol
SMILES c1c2c(ccc1)C(=O)CCCC2
SPLASH splash10-0gx0-3900000000-1273b6a9c593841e609d
Wiley ID 1501750