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(1H)Pyrrole-3-carboxylic acid, 1-(methoxymethyl)-5-[[4-(methylphenyl)sulfonyl]methyl]-, methyl ester
SpectraBase Compound ID G6Izn8evnh8
InChI InChI=1S/C16H19NO5S/c1-12-4-6-15(7-5-12)23(19,20)10-14-8-13(16(18)22-3)9-17(14)11-21-2/h4-9H,10-11H2,1-3H3
InChIKey RDGIOEAXBHZMIX-UHFFFAOYSA-N
Mol Weight 337.39 g/mol
Molecular Formula C16H19NO5S
Exact Mass 337.098394 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GRhdWuKqMym
Name (1H)Pyrrole-3-carboxylic acid, 1-(methoxymethyl)-5-[[4-(methylphenyl)sulfonyl]methyl]-, methyl ester
CAS Registry Number 155345-18-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H19NO5S
InChI InChI=1S/C16H19NO5S/c1-12-4-6-15(7-5-12)23(19,20)10-14-8-13(16(18)22-3)9-17(14)11-21-2/h4-9H,10-11H2,1-3H3
InChIKey RDGIOEAXBHZMIX-UHFFFAOYSA-N
Molecular Weight 337.390 g/mol
SMILES C(S(c1ccc(cc1)C)(=O)=O)c1[n](cc(c1)C(=O)OC)COC
SPLASH splash10-001i-0900000000-e4e1142931b7a2fb18e1
Source of Spectrum H1-38-500-1
Synonyms 1-(methoxymethyl)-5-(tosylmethyl)pyrrole-3-carboxylic acid methyl ester 1-(methoxymethyl)-5-[(4-methylphenyl)sulfonylmethyl]-3-pyrrolecarboxylic acid methyl ester Methyl 1-(methoxymethyl)-5-(p-tolylsulfonylmethyl)pyrrole-3-carboxylate Methyl 1-(methoxymethyl)-5-[(4-methylphenyl)sulfonylmethyl]pyrrole-3-carboxylate
Wiley ID 756039