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Methyl 4-[2-(2-Methyl-4-hydroxy thieno[2,3-d]pyrimidin-5-yl)ethyl]benzoate
SpectraBase Compound ID KDxGxHiXR9K
InChI InChI=1S/C17H16N2O3S/c1-10-18-15(20)14-13(9-23-16(14)19-10)8-5-11-3-6-12(7-4-11)17(21)22-2/h3-4,6-7,9H,5,8H2,1-2H3,(H,18,19,20)
InChIKey QLNJELLYZUDMRI-UHFFFAOYSA-N
Mol Weight 328.39 g/mol
Molecular Formula C17H16N2O3S
Exact Mass 328.088164 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6qBeVqdOKpA
Name Methyl 4-[2-(2-Methyl-4-hydroxy thieno[2,3-d]pyrimidin-5-yl)ethyl]benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16N2O3S
InChI InChI=1S/C17H16N2O3S/c1-10-18-15(20)14-13(9-23-16(14)19-10)8-5-11-3-6-12(7-4-11)17(21)22-2/h3-4,6-7,9H,5,8H2,1-2H3,(H,18,19,20)
InChIKey QLNJELLYZUDMRI-UHFFFAOYSA-N
Molecular Weight 328.386 g/mol
SMILES Oc1c2c(nc(n1)C)scc2CCc1ccc(C(=O)OC)cc1
SPLASH splash10-004i-0049000000-bdf5c382ae6a2eb769ee
Source of Spectrum H1-43-358-21
Synonyms Methyl 4-[2-(2-Methyl-4(3H)-oxothieno[2,3-d]pyrimidin-5-yl)ethyl]benzoate Methyl 4-[2-(4-hydroxy-2-methylthieno[2,3-d]pyrimidin-5-yl)ethyl]benzoate
Wiley ID 757806