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8,9-Dihydrobenzocyclohepten-5-one
SpectraBase Compound ID 5P1UXFNxEIR
InChI InChI=1S/C11H10O/c12-11-8-4-2-6-9-5-1-3-7-10(9)11/h1,3-5,7-8H,2,6H2
InChIKey JNRKVVIKJKHAJM-UHFFFAOYSA-N
Mol Weight 158.2 g/mol
Molecular Formula C11H10O
Exact Mass 158.073165 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ptI1S1KfPa
Name 8,9-Dihydrobenzocyclohepten-5-one
Alternate Name(s) 8,9-Dihydrobenzo[7]annulen-5-one
CAS Registry Number 45998-98-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H10O
InChI InChI=1S/C11H10O/c12-11-8-4-2-6-9-5-1-3-7-10(9)11/h1,3-5,7-8H,2,6H2
InChIKey JNRKVVIKJKHAJM-UHFFFAOYSA-N
Molecular Weight 158.200 g/mol
SMILES C1(c2c(CCC=C1)cccc2)=O
SPLASH splash10-0059-0900000000-0c83d55e6ef06bd593a7
Source of Spectrum C-100-5144-0
Wiley ID 1155844