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[Allyl-(toluene-4-sulfonyl)-amino]-acetic acid, methyl ester
SpectraBase Compound ID 1BhrgniIlXf
InChI InChI=1S/C13H17NO4S/c1-4-9-14(10-13(15)18-3)19(16,17)12-7-5-11(2)6-8-12/h4-8H,1,9-10H2,2-3H3
InChIKey ZEFJUTBNRVUEET-UHFFFAOYSA-N
Mol Weight 283.34 g/mol
Molecular Formula C13H17NO4S
Exact Mass 283.087829 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CYUZgrwMIGG
Name [ALLYL(TOLUENE-4-SULFONYL)AMINO]ACETIC ACID, METHYL ESTER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H17NO4S
InChI InChI=1S/C13H17NO4S/c1-4-9-14(10-13(15)18-3)19(16,17)12-7-5-11(2)6-8-12/h4-8H,1,9-10H2,2-3H3
InChIKey ZEFJUTBNRVUEET-UHFFFAOYSA-N
Molecular Weight 283.0874
SMILES c1cc(S(=O)(N(CC(OC)=O)CC=C)=O)ccc1C
SPLASH splash10-054o-9720000000-69b0edb500f126c30b1d
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany