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1H-1,2,3,4-Tetrazole, 5-(methylsulfinyl)-1-(4-nitrophenyl)-
SpectraBase Compound ID 7Ijqv60rXMP
InChI InChI=1S/C8H7N5O3S/c1-17(16)8-9-10-11-12(8)6-2-4-7(5-3-6)13(14)15/h2-5H,1H3
InChIKey AKJSVTHNLTXJPB-UHFFFAOYSA-N
Mol Weight 253.24 g/mol
Molecular Formula C8H7N5O3S
Exact Mass 253.02696 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6LZfN8Xbk9H
Name 1H-1,2,3,4-Tetrazole, 5-(methylsulfinyl)-1-(4-nitrophenyl)-
Alternate Name(s) 5-Methylsulfinyl-1-(4-nitrophenyl)-1,2,3,4-tetrazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H7N5O3S
InChI InChI=1S/C8H7N5O3S/c1-17(16)8-9-10-11-12(8)6-2-4-7(5-3-6)13(14)15/h2-5H,1H3
InChIKey AKJSVTHNLTXJPB-UHFFFAOYSA-N
Molecular Weight 253.236 g/mol
SMILES c1cc(ccc1N(=O)=O)-[n]1nnnc1S(=O)C
SPLASH splash10-03di-9510000000-53c0427b4986fafe53b4
Source of Spectrum IY-1-4336-7
Wiley ID 1651350