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(S)-4-Nitrobenzyl methyl sulfoxide
SpectraBase Compound ID Bbe00IukMPY
InChI InChI=1S/C8H9NO3S/c1-13(12)6-7-2-4-8(5-3-7)9(10)11/h2-5H,6H2,1H3
InChIKey XJQGAIWLCGGJBP-UHFFFAOYSA-N
Mol Weight 199.22 g/mol
Molecular Formula C8H9NO3S
Exact Mass 199.030314 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8Y4GVmelVKd
Name (S)-4-Nitrobenzyl methyl sulfoxide
Alternate Name(s) 1-[(methylsulfinyl)methyl]-4-nitrobenzene Methyl 4-nitrobenzyl sulfoxide
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Formula C8H9NO3S
InChI InChI=1S/C8H9NO3S/c1-13(12)6-7-2-4-8(5-3-7)9(10)11/h2-5H,6H2,1H3
InChIKey XJQGAIWLCGGJBP-UHFFFAOYSA-N
Molecular Weight 199.224 g/mol
SMILES c1(N(=O)=O)ccc(C[S@@](=O)C)cc1
SPLASH splash10-000i-6900000000-14d2d4bf69486faadefc
Source of Spectrum QC-6-1565-9
Wiley ID 868876