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2-Chloro-1,3,5-cycloheptatriene
SpectraBase Compound ID 6oyodZ7fXgV
InChI InChI=1S/C7H7Cl/c8-7-5-3-1-2-4-6-7/h1-3,5-6H,4H2
InChIKey HMCDTIPTNPHHQW-UHFFFAOYSA-N
Mol Weight 126.59 g/mol
Molecular Formula C7H7Cl
Exact Mass 126.023628 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HVXLoTeDX7N
Name 2-Chloro-1,3,5-cycloheptatriene
CAS Registry Number 34896-79-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H7Cl
InChI InChI=1S/C7H7Cl/c8-7-5-3-1-2-4-6-7/h1-3,5-6H,4H2
InChIKey HMCDTIPTNPHHQW-UHFFFAOYSA-N
Molecular Weight 126.586 g/mol
SMILES C=1(C=CC=CCC1)Cl
SPLASH splash10-0006-9400000000-8ae456a7d5595876898e
Source of Spectrum W5-3524-0-0
Synonyms 2-Chloranylcyclohepta-1,3,5-triene
Wiley ID 1129820