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(R)-2-Chloro-1,3-dioxo-1.lamba.(4),3.lamba.(4)-1,3-dithian-2-yl](4-nitrophenyl)methanol

View entire compound with spectra: 1 MS (GC)

(R)-2-Chloro-1,3-dioxo-1.lamba.(4),3.lamba.(4)-1,3-dithian-2-yl](4-nitrophenyl)methanol
SpectraBase Compound ID 8xvDEt5QP19
InChI InChI=1S/C11H12ClNO5S2/c12-11(19(17)6-1-7-20(11)18)10(14)8-2-4-9(5-3-8)13(15)16/h2-5,10,14H,1,6-7H2/t10-,11?,19?,20?/m1/s1
InChIKey TTXDONGJXXAVJN-AMKMCCFBSA-N
Mol Weight 337.79 g/mol
Molecular Formula C11H12ClNO5S2
Exact Mass 336.984543 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 315MZ0YYczJ
Name (R)-2-Chloro-1,3-dioxo-1.lamba.(4),3.lamba.(4)-1,3-dithian-2-yl](4-nitrophenyl)methanol
Alternate Name(s) (R)-(2-chloro-1,3-dioxido-1,3-dithian-2-yl)(4-nitrophenyl)methanol RS-[(1RS,3RS)-2-Chloro-1,3-dioxo-1.lamba.(4),3.lamba.(4)-1,3-dithian-2-yl](4-nitrophenyl)methanol
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Formula C11H12ClNO5S2
InChI InChI=1S/C11H12ClNO5S2/c12-11(19(17)6-1-7-20(11)18)10(14)8-2-4-9(5-3-8)13(15)16/h2-5,10,14H,1,6-7H2/t10-,11?,19?,20?/m1/s1
InChIKey TTXDONGJXXAVJN-AMKMCCFBSA-N
Molecular Weight 337.792 g/mol
SMILES O[C@@](C1([S@](=O)CCC[S@]1=O)Cl)(c1ccc(N(=O)=O)cc1)[H]
SPLASH splash10-0fk9-7900000000-1fd3a50e92cb38776a34
Source of Spectrum KC-0-17-7
Wiley ID 787069