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2-(4-Methoxyphenyl)-2,3,5,6,7,8-octahydro[1H]benzothieno[2,3-d]pyrimidin-4(1H)-one
SpectraBase Compound ID I6OG6ovL3wf
InChI InChI=1S/C17H18N2O2S/c1-21-11-8-6-10(7-9-11)15-18-16(20)14-12-4-2-3-5-13(12)22-17(14)19-15/h6-9,15,19H,2-5H2,1H3,(H,18,20)
InChIKey BRNGYCMPYHNLNG-UHFFFAOYSA-N
Mol Weight 314.4 g/mol
Molecular Formula C17H18N2O2S
Exact Mass 314.108899 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FJJKs03jiJ3
Name 2-(4-Methoxyphenyl)-2,3,5,6,7,8-octahydro[1H]benzothieno[2,3-d]pyrimidin-4(1H)-one
Alternate Name(s) 2-(4-Methoxyphenyl)-2,3,5,6,7,8-hexahydro-1H-[1]benzothiolo[2,3-d]pyrimidin-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18N2O2S
InChI InChI=1S/C17H18N2O2S/c1-21-11-8-6-10(7-9-11)15-18-16(20)14-12-4-2-3-5-13(12)22-17(14)19-15/h6-9,15,19H,2-5H2,1H3,(H,18,20)
InChIKey BRNGYCMPYHNLNG-UHFFFAOYSA-N
Molecular Weight 314.403 g/mol
SMILES N1C(NC(c2c1sc1c2CCCC1)=O)c1ccc(cc1)OC
SPLASH splash10-03dj-0049000000-5d35ec05bd9a5a436e63
Source of Spectrum Y-45-575-8c
Wiley ID 1666046