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3-(2-mercaptoethyl)-5,6,7,8-tetrahydro-1H-benzothiopheno[2,3-d]pyrimidine-2,4-quinone
SpectraBase Compound ID vt6gKq4pYn
InChI InChI=1S/C12H14N2O2S2/c15-11-9-7-3-1-2-4-8(7)18-10(9)13-12(16)14(11)5-6-17/h17H,1-6H2,(H,13,16)
InChIKey RYQHTMUAMHSDCV-UHFFFAOYSA-N
Mol Weight 282.38 g/mol
Molecular Formula C12H14N2O2S2
Exact Mass 282.04967 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AtzOgmUM6tS
Name 3-(2-mercaptoethyl)-5,6,7,8-tetrahydro-1H-benzothiopheno[2,3-d]pyrimidine-2,4-quinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14N2O2S2
InChI InChI=1S/C12H14N2O2S2/c15-11-9-7-3-1-2-4-8(7)18-10(9)13-12(16)14(11)5-6-17/h17H,1-6H2,(H,13,16)
InChIKey RYQHTMUAMHSDCV-UHFFFAOYSA-N
Molecular Weight 282.376 g/mol
SMILES N1C(N(CCS)C(c2c1sc1c2CCCC1)=O)=O
SPLASH splash10-00fr-0390000000-544363d16ab6b4bd36cc
Source of Spectrum D8-328-232-3
Synonyms 3-(2-mercaptoethyl)-5,6,7,8-tetrahydro-1H-[1]benzothiolo[2,3-d]pyrimidine-2,4-dione 3-(2-Sulfanylethyl)-5,6,7,8-tetrahydro-1H-benzothiopheno[2,3-d]pyrimidine-2,4-dione 3-(2-Sulfanylethyl)-5,6,7,8-tetrahydro-1H-[1]benzothiolo[2,3-d]pyrimidine-2,4-dione
Wiley ID 1515761