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3-Chloro-1,3,5-cycloheptatriene
SpectraBase Compound ID G6VsVTLX5Qn
InChI InChI=1S/C7H7Cl/c8-7-5-3-1-2-4-6-7/h1,3-6H,2H2
InChIKey ZVEDINUSVMUVJC-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 DV48ah6gODC
Name 3-Chloro-1,3,5-cycloheptatriene
Alternate Name(s) 3-Chloranylcyclohepta-1,3,5-triene
CAS Registry Number 55619-05-1
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/h1,3-6H,2H2
InChIKey ZVEDINUSVMUVJC-UHFFFAOYSA-N
Molecular Weight 126.586 g/mol
SMILES C1(=CC=CCC=C1)Cl
SPLASH splash10-0006-9100000000-328d82a513c66a835446
Source of Spectrum K-118-3522-12
Wiley ID 1129822