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Methyl 3-(1'-Tosylpyrrol-3'-yl)propanoate
SpectraBase Compound ID KQXAwhSXK9S
InChI InChI=1S/C15H17NO4S/c1-12-3-6-14(7-4-12)21(18,19)16-10-9-13(11-16)5-8-15(17)20-2/h3-4,6-7,9-11H,5,8H2,1-2H3
InChIKey JRIJQKSVKVVJKM-UHFFFAOYSA-N
Mol Weight 307.36 g/mol
Molecular Formula C15H17NO4S
Exact Mass 307.087829 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B4reOQgaylm
Name Methyl 3-(1'-Tosylpyrrol-3'-yl)propanoate
Alternate Name(s) Methyl 3-{1-[(4-methylphenyl)sulfonyl]-1H-pyrrol-3-yl}propanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H17NO4S
InChI InChI=1S/C15H17NO4S/c1-12-3-6-14(7-4-12)21(18,19)16-10-9-13(11-16)5-8-15(17)20-2/h3-4,6-7,9-11H,5,8H2,1-2H3
InChIKey JRIJQKSVKVVJKM-UHFFFAOYSA-N
Molecular Weight 307.364 g/mol
SMILES c1[n](S(c2ccc(cc2)C)(=O)=O)ccc1CCC(=O)OC
SPLASH splash10-052e-7393000000-0500d062c08bad53cf6e
Source of Spectrum SK-27-4117-6
Wiley ID 868148