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Pyrimido[4,5-b]benzothiophen-4(1H)-one, 5,6,7,8-tetrahydro-2-(1-phenylethyl)-
SpectraBase Compound ID BkSSUc9vzA3
InChI InChI=1S/C18H18N2OS/c1-11(12-7-3-2-4-8-12)16-19-17(21)15-13-9-5-6-10-14(13)22-18(15)20-16/h2-4,7-8,11H,5-6,9-10H2,1H3,(H,19,20,21)
InChIKey DGRLKZHPYZOEJC-UHFFFAOYSA-N
Mol Weight 310.42 g/mol
Molecular Formula C18H18N2OS
Exact Mass 310.113984 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1pxEncA3hHo
Name Pyrimido[4,5-b]benzothiophen-4(1H)-one, 5,6,7,8-tetrahydro-2-(1-phenylethyl)-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18N2OS
InChI InChI=1S/C18H18N2OS/c1-11(12-7-3-2-4-8-12)16-19-17(21)15-13-9-5-6-10-14(13)22-18(15)20-16/h2-4,7-8,11H,5-6,9-10H2,1H3,(H,19,20,21)
InChIKey DGRLKZHPYZOEJC-UHFFFAOYSA-N
Molecular Weight 310.415 g/mol
SMILES N1C(=NC(c2c1sc1c2CCCC1)=O)C(c1ccccc1)C
SPLASH splash10-0bt9-2954000000-9e7c30227f5d51ca23ae
Source of Spectrum AD-0-2532-0
Synonyms 2-(1-phenylethyl)-5,6,7,8-tetrahydro-3H-benzothiopheno[2,3-d]pyrimidin-4-one 2-(1-phenylethyl)-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one 2-(1-Phenylethyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(1H)-one
Wiley ID 1430536