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t-Butyl 3-(methyl)-4-phenylsulfonyl-2-pyrrolecarboxylate
SpectraBase Compound ID FjzTYJjIYp2
InChI InChI=1S/C16H19NO4S/c1-11-13(22(19,20)12-8-6-5-7-9-12)10-17-14(11)15(18)21-16(2,3)4/h5-10,17H,1-4H3
InChIKey WNVDCOASNROUJM-UHFFFAOYSA-N
Mol Weight 321.39 g/mol
Molecular Formula C16H19NO4S
Exact Mass 321.103479 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B2bJFYoL4Uq
Name t-Butyl 3-(methyl)-4-phenylsulfonyl-2-pyrrolecarboxylate
Alternate Name(s) tert-Butyl 3-methyl-4-(phenylsulfonyl)-1H-pyrrole-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H19NO4S
InChI InChI=1S/C16H19NO4S/c1-11-13(22(19,20)12-8-6-5-7-9-12)10-17-14(11)15(18)21-16(2,3)4/h5-10,17H,1-4H3
InChIKey WNVDCOASNROUJM-UHFFFAOYSA-N
Molecular Weight 321.391 g/mol
SMILES [nH]1cc(c(c1C(=O)OC(C)(C)C)C)S(=O)(=O)c1ccccc1
SPLASH splash10-01b9-0390000000-aa7fa6adb93b9d690809
Source of Spectrum AJ-67-1446-5
Wiley ID 772619