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2-(6-Amino-9H-purin-8-ylsulfanyl)-N-furan-2-ylmethyl-acetamide
SpectraBase Compound ID 2MoMaIOx6S9
InChI InChI=1S/C12H12N6O2S/c13-10-9-11(16-6-15-10)18-12(17-9)21-5-8(19)14-4-7-2-1-3-20-7/h1-3,6H,4-5H2,(H,14,19)(H3,13,15,16,17,18)
InChIKey XFKWLRUSFJCSSS-UHFFFAOYSA-N
Mol Weight 304.33 g/mol
Molecular Formula C12H12N6O2S
Exact Mass 304.074245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ZRrB1xZvE
Name 2-(6-Amino-9H-purin-8-ylsulfanyl)-N-furan-2-ylmethyl-acetamide
Alternate Name(s) 2-[(6-amino-7H-purin-8-yl)sulfanyl]-N-(2-furylmethyl)acetamide 2-[(6-amino-7H-purin-8-yl)sulfanyl]-N-(furan-2-ylmethyl)acetamide 2-[(6-amino-7H-purin-8-yl)thio]-N-(2-furanylmethyl)acetamide 2-[(6-amino-7H-purin-8-yl)thio]-N-(2-furfuryl)acetamide 2-[(6-Amino-9H-purin-8-yl)sulfanyl]-N-(2-furylmethyl)acetamide 2-[(6-azanyl-7H-purin-8-yl)sulfanyl]-N-(furan-2-ylmethyl)ethanamide
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Formula C12H12N6O2S
InChI InChI=1S/C12H12N6O2S/c13-10-9-11(16-6-15-10)18-12(17-9)21-5-8(19)14-4-7-2-1-3-20-7/h1-3,6H,4-5H2,(H,14,19)(H3,13,15,16,17,18)
InChIKey XFKWLRUSFJCSSS-UHFFFAOYSA-N
Molecular Weight 304.328 g/mol
SMILES N(C(CSc1nc2c(ncnc2[nH]1)N)=O)Cc1occc1
SPLASH splash10-00kr-2900000000-4dd8c276414f62bde4a8
Wiley ID 1464179