S,S'-Bis[2-(methylaminocarbonyl)-3,5-dinitrophen-1-yl]disulfide

SpectraBase Compound ID	4sK93eekq15
InChI	InChI=1S/C16H12N6O10S2/c1-17-15(23)13-9(21(29)30)3-7(19(25)26)5-11(13)33-34-12-6-8(20(27)28)4-10(22(31)32)14(12)16(24)18-2/h3-6H,1-2H3,(H,17,23)(H,18,24)
InChIKey	OBPJXBZKODSNHF-UHFFFAOYSA-N Google Search
Mol Weight	512.42 g/mol
Molecular Formula	C16H12N6O10S2
Exact Mass	512.005633 g/mol

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SpectraBase Spectrum ID	4n7otRHajoh
Name	S,S'-Bis[2-(methylaminocarbonyl)-3,5-dinitrophen-1-yl]disulfide
Alternate Name(s)	N-methyl-2-({2-[(methylamino)carbonyl]-3,5-dinitrophenyl}disulfanyl)-4,6-dinitrobenzamide
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C16H12N6O10S2
InChI	InChI=1S/C16H12N6O10S2/c1-17-15(23)13-9(21(29)30)3-7(19(25)26)5-11(13)33-34-12-6-8(20(27)28)4-10(22(31)32)14(12)16(24)18-2/h3-6H,1-2H3,(H,17,23)(H,18,24)
InChIKey	OBPJXBZKODSNHF-UHFFFAOYSA-N
Molecular Weight	512.424 g/mol
SMILES	N(C(c1c(SSc2cc(cc(c2C(=O)NC)N(=O)=O)N(=O)=O)cc(cc1N(=O)=O)N(=O)=O)=O)C
SPLASH	splash10-052b-0980000000-8c091e4dd2dc6bb027c5
Source of Spectrum	H1-68-2494-36
Wiley ID	1593717