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p-nitrobenzyl p-tolyl sulfone
SpectraBase Compound ID 5Hrbj6aAFJY
InChI InChI=1S/C14H13NO4S/c1-11-2-8-14(9-3-11)20(18,19)10-12-4-6-13(7-5-12)15(16)17/h2-9H,10H2,1H3
InChIKey ONALOSSDMHSJLB-UHFFFAOYSA-N
Mol Weight 291.32 g/mol
Molecular Formula C14H13NO4S
Exact Mass 291.056529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3hk3uH4y6LF
Name 1-Methyl-4-[(4-nitrobenzyl)sulfonyl]benzene
Alternate Name(s) 1-Methyl-4-[(4-nitrophenyl)methylsulfonyl]benzene 4-Methylphenyl 4-nitrobenzyl sulfone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H13NO4S
InChI InChI=1S/C14H13NO4S/c1-11-2-8-14(9-3-11)20(18,19)10-12-4-6-13(7-5-12)15(16)17/h2-9H,10H2,1H3
InChIKey ONALOSSDMHSJLB-UHFFFAOYSA-N
Molecular Weight 291.321 g/mol
SMILES c1(S(Cc2ccc(N(=O)=O)cc2)(=O)=O)ccc(cc1)C
SPLASH splash10-0a4l-4920000000-efbea0f8251c298d9489
Source of Spectrum F-54-6815-6
Wiley ID 807606