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Benzenesulfonic acid, 3-nitro-, methyl ester
SpectraBase Compound ID 6ZZ35aPgeqc
InChI InChI=1S/C7H7NO5S/c1-13-14(11,12)7-4-2-3-6(5-7)8(9)10/h2-5H,1H3
InChIKey SWKKKZKIPZOMBG-UHFFFAOYSA-N
Mol Weight 217.19 g/mol
Molecular Formula C7H7NO5S
Exact Mass 217.004493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1uD0OYo43c
Name Benzenesulfonic acid, 3-nitro-, methyl ester
Alternate Name(s) 3-Nitrobenzenesulfonic acid methyl ester Methyl 3-nitrobenzenesulfonate
CAS Registry Number 6214-21-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H7NO5S
InChI InChI=1S/C7H7NO5S/c1-13-14(11,12)7-4-2-3-6(5-7)8(9)10/h2-5H,1H3
InChIKey SWKKKZKIPZOMBG-UHFFFAOYSA-N
Molecular Weight 217.195 g/mol
SMILES c1(N(=O)=O)cc(ccc1)S(=O)(=O)OC
SPLASH splash10-00b9-9310000000-5ca774437fde64f4f057
Wiley ID 1482091