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1H-Furo[3,4-c]pyrrole-4-carbothioic acid, 3,3a,4,6a-tetrahydro-4-methyl-1,3-dioxo-6-phenyl-, S-(tetrahydro-2,5-dioxo-3-furanyl) ester

View entire compound with spectra: 1 MS (GC)

1H-Furo[3,4-c]pyrrole-4-carbothioic acid, 3,3a,4,6a-tetrahydro-4-methyl-1,3-dioxo-6-phenyl-, S-(tetrahydro-2,5-dioxo-3-furanyl) ester
SpectraBase Compound ID JQaXRGWRs4C
InChI InChI=1S/C18H13NO7S/c1-18(17(24)27-9-7-10(20)25-14(9)21)12-11(15(22)26-16(12)23)13(19-18)8-5-3-2-4-6-8/h2-6,9,11-12H,7H2,1H3
InChIKey VIDSONYLVDKPBK-UHFFFAOYSA-N
Mol Weight 387.36 g/mol
Molecular Formula C18H13NO7S
Exact Mass 387.041273 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DmscCoMJwTw
Name 1H-Furo[3,4-c]pyrrole-4-carbothioic acid, 3,3a,4,6a-tetrahydro-4-methyl-1,3-dioxo-6-phenyl-, S-(tetrahydro-2,5-dioxo-3-furanyl) ester
CAS Registry Number 60026-98-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H13NO7S
InChI InChI=1S/C18H13NO7S/c1-18(17(24)27-9-7-10(20)25-14(9)21)12-11(15(22)26-16(12)23)13(19-18)8-5-3-2-4-6-8/h2-6,9,11-12H,7H2,1H3
InChIKey VIDSONYLVDKPBK-UHFFFAOYSA-N
Molecular Weight 387.362 g/mol
SMILES C12C(C(c3ccccc3)=NC1(C(SC1C(OC(C1)=O)=O)=O)C)C(=O)OC2=O
SPLASH splash10-0a6r-0930000000-3a3698520a67ac6c3db6
Source of Spectrum F-32-574-0
Synonyms S-(2,5-dioxotetrahydro-3-furanyl) 4-methyl-1,3-dioxo-6-phenyl-3,3a,4,6a-tetrahydro-1H-furo[3,4-c]pyrrole-4-carbothioate S-(2.5-dioxotetrahydrofuran-3-yl)-5-methyl-2-phenyl-1-pyrroline 3.4-dicarboxylicanhydride-5-thiolcarboxylate
Wiley ID 1363302