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4-Azido-2-benzyl-6-nitro-1-oxo-1,2-dihydro-benzo[d]isothiazol-3-one
SpectraBase Compound ID 1XwOIWo5zRT
InChI InChI=1S/C14H9N5O4S/c15-17-16-11-6-10(19(21)22)7-12-13(11)14(20)18(24(12)23)8-9-4-2-1-3-5-9/h1-7H,8H2
InChIKey VTERQTXNYMKNAR-UHFFFAOYSA-N
Mol Weight 343.32 g/mol
Molecular Formula C14H9N5O4S
Exact Mass 343.037525 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FuOCrAiVEwx
Name 4-Azido-2-benzyl-6-nitro-1-oxo-1,2-dihydro-benzo[d]isothiazol-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H9N5O4S
InChI InChI=1S/C14H9N5O4S/c15-17-16-11-6-10(19(21)22)7-12-13(11)14(20)18(24(12)23)8-9-4-2-1-3-5-9/h1-7H,8H2
InChIKey VTERQTXNYMKNAR-UHFFFAOYSA-N
Molecular Weight 343.317 g/mol
SMILES c1ccc(CN2S(c3cc(N(=O)=O)cc(c3C2=O)N=[N+]=[N-])=O)cc1
SPLASH splash10-0006-9200000000-1775368a9fbb498aaa8a
Synonyms 4-Azido-2-benzyl-1-keto-6-nitro-1,2-benzothiazol-3-one 4-Azido-2-benzyl-6-nitro-1-oxo-1,2-benzothiazol-3-one 4-Azido-6-nitro-1-oxidanylidene-2-(phenylmethyl)-1,2-benzothiazol-3-one 4-Azido-6-nitro-1-oxo-2-(phenylmethyl)-1,2-benzothiazol-3-one
Wiley ID 1458746