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Methyl 2-((4-methyl-N-(prop-2-ynyl)phenylsulfonamido)methyl)cycloprop-2-enecarboxylate
SpectraBase Compound ID 3sC7lbIKdFG
InChI InChI=1S/C16H17NO4S/c1-4-9-17(11-13-10-15(13)16(18)21-3)22(19,20)14-7-5-12(2)6-8-14/h1,5-8,10,15H,9,11H2,2-3H3
InChIKey VJVCUXMUVRVQAC-UHFFFAOYSA-N
Mol Weight 319.38 g/mol
Molecular Formula C16H17NO4S
Exact Mass 319.087829 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 54eBpAcfYcv
Name Methyl 2-((4-methyl-N-(prop-2-ynyl)phenylsulfonamido)methyl)cycloprop-2-enecarboxylate
Alternate Name(s) Methyl 2-((4-methyl-N-(prop-2-yn-1-yl)phenylsulfonamido)methyl)cycloprop-2-enecarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H17NO4S
InChI InChI=1S/C16H17NO4S/c1-4-9-17(11-13-10-15(13)16(18)21-3)22(19,20)14-7-5-12(2)6-8-14/h1,5-8,10,15H,9,11H2,2-3H3
InChIKey VJVCUXMUVRVQAC-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol101455c
Molecular Weight 319.375 g/mol
SMILES c1(S(N(CC=2C(C2)C(OC)=O)CC#C)(=O)=O)ccc(cc1)C
SPLASH splash10-01ox-9800000000-5f3c65af7b04c561db4e
Source of Spectrum A1-12-4462/SMS18-1d
Wiley ID 1752433