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Phosphorodithioic acid, O,O-dimethyl ester, S-ester with 6,8-dibromo-3-(mercaptomethyl)-1,2,3-benzotriazin-4(3H)-one
SpectraBase Compound ID 5N1EQHLyGzw
InChI InChI=1S/C10H10Br2N3O3PS2/c1-17-19(20,18-2)21-5-15-10(16)7-3-6(11)4-8(12)9(7)13-14-15/h3-4H,5H2,1-2H3
InChIKey JOQSTMUSLLIZLZ-UHFFFAOYSA-N
Mol Weight 475.11 g/mol
Molecular Formula C10H10Br2N3O3PS2
Exact Mass 472.826797 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3zL43N0k7Ft
Name Phosphorodithioic acid, O,O-dimethyl ester, S-ester with 6,8-dibromo-3-(mercaptomethyl)-1,2,3-benzotriazin-4(3H)-one
Alternate Name(s) Phosphorodithioic acid, S-((6,8-dibromo-4-oxo-1,2,3-benzotriazin-3 S-[(6,8-dibromo-4-oxo-1,2,3-benzotriazin-3(4H)-yl)methyl]O,O-dimethyl dithiophosphate
CAS Registry Number 27469-73-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H10Br2N3O3PS2
InChI InChI=1S/C10H10Br2N3O3PS2/c1-17-19(20,18-2)21-5-15-10(16)7-3-6(11)4-8(12)9(7)13-14-15/h3-4H,5H2,1-2H3
InChIKey JOQSTMUSLLIZLZ-UHFFFAOYSA-N
Molecular Weight 475.110 g/mol
SMILES c12C(N(CSP(=S)(OC)OC)N=Nc2c(Br)cc(c1)Br)=O
SPLASH splash10-014l-9668000000-2531a5c2734becf6a645
Source of Spectrum RB-1982-15530-0
Wiley ID 124931