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3,4-Dihydro-2,2,4-trimethyl-3-[(2',4',6'-trinitrophenyl)imino]-2H-1,4-benzthiazine
SpectraBase Compound ID 8fgG4uQJEtR
InChI InChI=1S/C17H15N5O6S/c1-17(2)16(19(3)11-6-4-5-7-14(11)29-17)18-15-12(21(25)26)8-10(20(23)24)9-13(15)22(27)28/h4-9H,1-3H3/b18-16+
InChIKey JYPIISCBODJEOR-FBMGVBCBSA-N
Mol Weight 417.4 g/mol
Molecular Formula C17H15N5O6S
Exact Mass 417.074304 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5JlCjkSMYPB
Name 3,4-Dihydro-2,2,4-trimethyl-3-[(2',4',6'-trinitrophenyl)imino]-2H-1,4-benzthiazine
CAS Registry Number 143268-69-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H15N5O6S
InChI InChI=1S/C17H15N5O6S/c1-17(2)16(19(3)11-6-4-5-7-14(11)29-17)18-15-12(21(25)26)8-10(20(23)24)9-13(15)22(27)28/h4-9H,1-3H3/b18-16+
InChIKey JYPIISCBODJEOR-FBMGVBCBSA-N
Molecular Weight 417.396 g/mol
SMILES c1(c(N(=O)=O)cc(N(=O)=O)cc1N(=O)=O)\N=C/1N(c2ccccc2SC1(C)C)C
SPLASH splash10-00kf-1900300000-4864fc824f20d3b01b2d
Source of Spectrum U-1992-1268-26
Synonyms 2,4,6-trinitro-N-((3E)-2,2,4-trimethyl-2H-1,4-benzothiazin-3(4H)-ylidene)aniline N-((3E)-2,2,4-trimethyl-2H-1,4-benzothiazin-3(4H)-ylidene)-N-(2,4,6-trinitrophenyl)amine
Wiley ID 764651