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N-(3,4-dimethylphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-amine

View entire compound with spectra: 2 NMR

N-(3,4-dimethylphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-amine
SpectraBase Compound ID HdQpu9jae5L
InChI InChI=1S/C18H19N3S/c1-11-7-8-13(9-12(11)2)21-17-16-14-5-3-4-6-15(14)22-18(16)20-10-19-17/h7-10H,3-6H2,1-2H3,(H,19,20,21)
InChIKey QUFXVKIOMCRHMW-UHFFFAOYSA-N
Mol Weight 309.43 g/mol
Molecular Formula C18H19N3S
Exact Mass 309.129969 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5iBiVgOKP3P
Name N-(3,4-Dimethylphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-D]pyrimidin-4-amine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 309.129968798 u
Formula C18H19N3S
InChI InChI=1S/C18H19N3S/c1-11-7-8-13(9-12(11)2)21-17-16-14-5-3-4-6-15(14)22-18(16)20-10-19-17/h7-10H,3-6H2,1-2H3,(H,19,20,21)
InChIKey QUFXVKIOMCRHMW-UHFFFAOYSA-N
Molecular Weight 309.431 g/mol
SMILES N(C=1C2=C(SC3=C2CCCC3)N=CN1)C=1C=C(C)C(=CC1)C