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N-(4-Nitrobenzenesulfonyl) methyl [5-(N-phenyltetrazolyl)] sulfilimine
SpectraBase Compound ID CrCJYdDpmo5
InChI InChI=1S/C14H12N6O4S2/c1-25(14-15-16-17-19(14)11-5-3-2-4-6-11)18-26(23,24)13-9-7-12(8-10-13)20(21)22/h2-10H,1H3
InChIKey XISYBAXBGMQUNL-UHFFFAOYSA-N
Mol Weight 392.41 g/mol
Molecular Formula C14H12N6O4S2
Exact Mass 392.036145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6gdm2X4tArz
Name N-(4-Nitrobenzenesulfonyl) methyl [5-(N-phenyltetrazolyl)] sulfilimine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H12N6O4S2
InChI InChI=1S/C14H12N6O4S2/c1-25(14-15-16-17-19(14)11-5-3-2-4-6-11)18-26(23,24)13-9-7-12(8-10-13)20(21)22/h2-10H,1H3
InChIKey XISYBAXBGMQUNL-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol900660x
Molecular Weight 392.408 g/mol
SMILES c1([n](nnn1)-c1ccccc1)S(C)=NS(=O)(c1ccc(cc1)[N+](=O)[O-])=O
SPLASH splash10-014i-3900000000-bfe0df75f3ad6e0adcbd
Source of Spectrum A1-11-2429/SMS9-3b
Wiley ID 1756803