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(3E)-1-(2-Chloroethyl)-1H-indole-2,3-dione 3-semicarbazone
SpectraBase Compound ID 48Hy6apAwh0
InChI InChI=1S/C11H11ClN4O2/c12-5-6-16-8-4-2-1-3-7(8)9(10(16)17)14-15-11(13)18/h1-4H,5-6H2,(H3,13,15,18)/b14-9+
InChIKey YSMWETYJNNSROV-NTEUORMPSA-N
Mol Weight 266.69 g/mol
Molecular Formula C11H11ClN4O2
Exact Mass 266.057053 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GgbyGXawk9d
Name (3E)-1-(2-Chloroethyl)-1H-indole-2,3-dione 3-semicarbazone
Alternate Name(s) 1-[(E)-[1-(2-chloroethyl)-2-oxidanylidene-indol-3-ylidene]amino]urea Indole-2,3(2H,3H)-dione, 1-(2-chloroethyl)-, 3-semicarbazone [(E)-[1-(2-chloroethyl)-2-keto-indolin-3-ylidene]amino]urea [(E)-[1-(2-chloroethyl)-2-oxo-3-indolylidene]amino]urea [(E)-[1-(2-chloroethyl)-2-oxo-indolin-3-ylidene]amino]urea [(E)-[1-(2-chloroethyl)-2-oxoindol-3-ylidene]amino]urea
CAS Registry Number 85731-62-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11ClN4O2
InChI InChI=1S/C11H11ClN4O2/c12-5-6-16-8-4-2-1-3-7(8)9(10(16)17)14-15-11(13)18/h1-4H,5-6H2,(H3,13,15,18)/b14-9+
InChIKey YSMWETYJNNSROV-NTEUORMPSA-N
Molecular Weight 266.688 g/mol
SMILES N(\N=C\1C(N(c2ccccc12)CCCl)=O)C(N)=O
SPLASH splash10-00xv-7920000000-ac6a3aa5cae7a1282afc
Source of Spectrum AD-0-2532-0
Wiley ID 1425336