Product Name 1-Methyl-4(1H)-pyrimidinethione
CAS
MFC5H6N2S
MW126.17954
InChIInChI=1S/C5H6N2S/c1-7-3-2-5(8)6-4-7/h2-4H,1H3
InChIKeyMNQTVKDYYQXZSE-UHFFFAOYSA-N
SmilesC1N(C)C=CC(=S)N=1
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Parameter ppm Hz D(A) 8.32 D(B) 7.10 D(C) 7.55 J(A,B) 0.8 J(A,C) 2.0 J(B,C) 6.7 D(D) 3.62 BAUER,L. ET AL. J.HETEROCYCL.CHEM. 2, 447 (1965)
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