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2,1,3-Benzothiadiazole, 7-chloro-5-nitro-4-phenoxy-
SpectraBase Compound ID 9E8d3DibfTW
InChI InChI=1S/C12H6ClN3O3S/c13-8-6-9(16(17)18)12(11-10(8)14-20-15-11)19-7-4-2-1-3-5-7/h1-6H
InChIKey HFIJIZWEBURWIR-UHFFFAOYSA-N
Mol Weight 307.71 g/mol
Molecular Formula C12H6ClN3O3S
Exact Mass 306.98184 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID dKFgZzdCEO
Name 2,1,3-Benzothiadiazole, 7-chloro-5-nitro-4-phenoxy-
CAS Registry Number 16407-94-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H6ClN3O3S
InChI InChI=1S/C12H6ClN3O3S/c13-8-6-9(16(17)18)12(11-10(8)14-20-15-11)19-7-4-2-1-3-5-7/h1-6H
InChIKey HFIJIZWEBURWIR-UHFFFAOYSA-N
Molecular Weight 307.711 g/mol
SMILES c1(c(c2nsnc2c(c1)Cl)Oc1ccccc1)N(=O)=O
SPLASH splash10-0006-9121000000-2bc4aee30c21fd412b9e
Source of Spectrum SB-29-623-0
Synonyms 4-Chloro-6-nitro-7-phenoxybenzo-2,1,3-thiadiazone 7-Chloro-5-nitro-2,1,3-benzothiadiazol-4-yl phenyl ether 7-Chloro-5-nitro-4-phenoxy-2,1,3-benzothiadiazole
Wiley ID 1308774