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(S)-(+)-N-[4-(1-Hydroxy-2-nitroethyl)phenyl]methanesulfonamide

View entire compound with spectra: 1 MS (GC)

(S)-(+)-N-[4-(1-Hydroxy-2-nitroethyl)phenyl]methanesulfonamide
SpectraBase Compound ID K4rDb3GPbso
InChI InChI=1S/C9H12N2O5S/c1-17(15,16)10-8-4-2-7(3-5-8)9(12)6-11(13)14/h2-5,9-10,12H,6H2,1H3/t9-/m1/s1
InChIKey JIYBVSYCDJSGTL-SECBINFHSA-N
Mol Weight 260.26 g/mol
Molecular Formula C9H12N2O5S
Exact Mass 260.046693 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6xrjzysZfkP
Name (S)-(+)-N-[4-(1-Hydroxy-2-nitroethyl)phenyl]methanesulfonamide
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Formula C9H12N2O5S
InChI InChI=1S/C9H12N2O5S/c1-17(15,16)10-8-4-2-7(3-5-8)9(12)6-11(13)14/h2-5,9-10,12H,6H2,1H3/t9-/m1/s1
InChIKey JIYBVSYCDJSGTL-SECBINFHSA-N
Molecular Weight 260.264 g/mol
SMILES N(S(=O)(=O)C)c1ccc([C@@](CN(=O)=O)(O)[H])cc1
SPLASH splash10-0002-2900000000-5d00ccbfc87f4a136fe3
Source of Spectrum QC-21-580-5
Synonyms N-[4-[(1S)-1-hydroxy-2-nitroethyl]phenyl]methanesulfonamide N-[4-[(1S)-2-nitro-1-oxidanyl-ethyl]phenyl]methanesulfonamide
Wiley ID 1688193