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3,3-dichlorohexahydro-2H-azepine-2-one
SpectraBase Compound ID JYNM6gAC7L9
InChI InChI=1S/C6H9Cl2NO/c7-6(8)3-1-2-4-9-5(6)10/h1-4H2,(H,9,10)
InChIKey YBOFMSCOQHPFRN-UHFFFAOYSA-N
Mol Weight 182.05 g/mol
Molecular Formula C6H9Cl2NO
Exact Mass 181.006119 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CMHUyM3wMPt
Name 2H-Azepin-2-one, 3,3-dichlorohexahydro-
CAS Registry Number 1709-14-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H9Cl2NO
InChI InChI=1S/C6H9Cl2NO/c7-6(8)3-1-2-4-9-5(6)10/h1-4H2,(H,9,10)
InChIKey YBOFMSCOQHPFRN-UHFFFAOYSA-N
Molecular Weight 182.050 g/mol
SMILES N1CCCCC(C1=O)(Cl)Cl
SPLASH splash10-001i-4900000000-e2d536cf5aa64124b22a
Source of Spectrum RB-1982-15600-0
Synonyms 3,3-bis(chloranyl)azepan-2-one 3,3-Dichloro-2-azepanone 3,3-Dichloroazepan-2-one
Wiley ID 1177196