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1,2-Benzo-1,3,5-cycloheptatriene
SpectraBase Compound ID L5jzh5loAju
InChI InChI=1S/C11H10/c1-2-6-10-8-4-5-9-11(10)7-3-1/h1-6,8-9H,7H2
InChIKey XHVULKQHRQZNMW-UHFFFAOYSA-N
Mol Weight 142.2 g/mol
Molecular Formula C11H10
Exact Mass 142.07825 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7nizoOgRYzo
Name 1,2-Benzo-1,3,5-cycloheptatriene
Alternate Name(s) 5H-Benzo[a]cycloheptene 5H-Benzocycloheptene 3,4-Benzotropilidene 9H-Benzocycloheptene 9H-Benzo[7]annulene Benzocycloheptatriene
CAS Registry Number 264-09-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H10
InChI InChI=1S/C11H10/c1-2-6-10-8-4-5-9-11(10)7-3-1/h1-6,8-9H,7H2
InChIKey XHVULKQHRQZNMW-UHFFFAOYSA-N
Molecular Weight 142.201 g/mol
SMILES c1ccc2C=CC=CCc2c1
SPLASH splash10-0006-3900000000-efc84b13dbb6ef68fbdb
Source of Spectrum CM-1999-35134-0
Wiley ID 497488