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7-Methyl-4-(pent-1-yn-5-yl)-1-phenylsulfonylpyrano[3,4-b]pyrrol-5(1H)-one
SpectraBase Compound ID 9nikBYbq83n
InChI InChI=1S/C19H17NO4S/c1-3-4-6-11-17-16-12-13-20(18(16)14(2)24-19(17)21)25(22,23)15-9-7-5-8-10-15/h1,5,7-10,12-13H,4,6,11H2,2H3
InChIKey FTQHZXKHOFBRNF-UHFFFAOYSA-N
Mol Weight 355.41 g/mol
Molecular Formula C19H17NO4S
Exact Mass 355.087829 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 47F8ySbBNzh
Name 7-Methyl-4-(pent-1-yn-5-yl)-1-phenylsulfonylpyrano[3,4-b]pyrrol-5(1H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H17NO4S
InChI InChI=1S/C19H17NO4S/c1-3-4-6-11-17-16-12-13-20(18(16)14(2)24-19(17)21)25(22,23)15-9-7-5-8-10-15/h1,5,7-10,12-13H,4,6,11H2,2H3
InChIKey FTQHZXKHOFBRNF-UHFFFAOYSA-N
Molecular Weight 355.408 g/mol
SMILES c1(S(N2C=3C(=C(CCCC#C)C(OC3C)=O)C=C2)(=O)=O)ccccc1
SPLASH splash10-00di-0902000000-d428ee1a4e05045db183
Source of Spectrum F-48-7463-22
Synonyms 7-Methyl-4-(4-pentynyl)-1-(phenylsulfonyl)pyrano[3,4-b]pyrrol-5(1H)-one
Wiley ID 1345217