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2H-1,2,3-Benzothiadiazine, 2-(2,4-dinitrophenyl)-5,6,7,8-tetrahydro-, monoperchlorate
SpectraBase Compound ID 2dUL1cDNrgE
InChI InChI=1S/C13H12N4O4S.ClHO4/c18-16(19)10-5-6-11(12(7-10)17(20)21)15-14-8-9-3-1-2-4-13(9)22-15;2-1(3,4)5/h5-8H,1-4H2;(H,2,3,4,5)
InChIKey JDNGTIDEIUCYTM-UHFFFAOYSA-N
Mol Weight 420.78 g/mol
Molecular Formula C13H13ClN4O8S
Exact Mass 420.014262 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GpOeF9aJ3HG
Name 2H-1,2,3-Benzothiadiazine, 2-(2,4-dinitrophenyl)-5,6,7,8-tetrahydro-, monoperchlorate
Alternate Name(s) perchloric acid compound with 2-(2,4-dinitrophenyl)-5,6,7,8-tetrahydro-2H-1,2,3-benzothiadiazine (1:1)
CAS Registry Number 42141-11-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13ClN4O8S
InChI InChI=1S/C13H12N4O4S.ClHO4/c18-16(19)10-5-6-11(12(7-10)17(20)21)15-14-8-9-3-1-2-4-13(9)22-15;2-1(3,4)5/h5-8H,1-4H2;(H,2,3,4,5)
InChIKey JDNGTIDEIUCYTM-UHFFFAOYSA-N
Molecular Weight 420.780 g/mol
SMILES O[Cl](=O)(=O)=O.c1(N2SC=3CCCCC3C=N2)c(N(=O)=O)cc(N(=O)=O)cc1
SPLASH splash10-0019-0900000000-e96db7f7da932a01e8a0
Source of Spectrum W5-34422-31114-31114
Wiley ID 1377735