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2-Methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-D]pyrimidin-4-ylamine, ac derivative
SpectraBase Compound ID B23gwzsGB3t
InChI InChI=1S/C13H15N3OS/c1-7-14-12(16-8(2)17)11-9-5-3-4-6-10(9)18-13(11)15-7/h3-6H2,1-2H3,(H,14,15,16,17)
InChIKey GCIPRMDPZZGWRR-UHFFFAOYSA-N
Mol Weight 261.34 g/mol
Molecular Formula C13H15N3OS
Exact Mass 261.093583 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Coar0Ib0wQA
Name 2-Methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-D]pyrimidin-4-ylamine, ac derivative
Comments Computed using HOSE algorithm
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Exact Mass 261.093583288 u
Formula C13H15N3OS
InChI InChI=1S/C13H15N3OS/c1-7-14-12(16-8(2)17)11-9-5-3-4-6-10(9)18-13(11)15-7/h3-6H2,1-2H3,(H,14,15,16,17)
InChIKey GCIPRMDPZZGWRR-UHFFFAOYSA-N
Molecular Weight 261.343 g/mol
SMILES CC(=O)NC1=C2C=3CCCCC3SC2=NC(C)=N1