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1-[3-(5,6,7,8-Tetrahydrobenzothieno[2,3-d]pyrimidin-4-yl)phenyl]ethanone
SpectraBase Compound ID 3MnXwxsZDkh
InChI InChI=1S/C18H16N2OS/c1-11(21)12-5-4-6-13(9-12)17-16-14-7-2-3-8-15(14)22-18(16)20-10-19-17/h4-6,9-10H,2-3,7-8H2,1H3
InChIKey JXXSTLBKQQKYDX-UHFFFAOYSA-N
Mol Weight 308.4 g/mol
Molecular Formula C18H16N2OS
Exact Mass 308.098334 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8CYAICCDE0y
Name 1-[3-(5,6,7,8-Tetrahydrobenzothieno[2,3-d]pyrimidin-4-yl)phenyl]ethanone
Alternate Name(s) 1-[3-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)phenyl]ethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H16N2OS
InChI InChI=1S/C18H16N2OS/c1-11(21)12-5-4-6-13(9-12)17-16-14-7-2-3-8-15(14)22-18(16)20-10-19-17/h4-6,9-10H,2-3,7-8H2,1H3
InChIKey JXXSTLBKQQKYDX-UHFFFAOYSA-N
Molecular Weight 308.399 g/mol
SMILES c12c(sc3c2CCCC3)ncnc1-c1cc(C(=O)C)ccc1
SPLASH splash10-0a5c-0095000000-ceb2307a22be9e8a65ec
Source of Spectrum Y-46-463-6b
Wiley ID 1666722