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6-benzyloxy-9-(1,2,2-trichlorovinyl)purin-2-amine
SpectraBase Compound ID CQSxZFDTj4G
InChI InChI=1S/C14H10Cl3N5O/c15-10(16)11(17)22-7-19-9-12(22)20-14(18)21-13(9)23-6-8-4-2-1-3-5-8/h1-5,7H,6H2,(H2,18,20,21)
InChIKey AMJWYSOJJZHJOK-UHFFFAOYSA-N
Mol Weight 370.63 g/mol
Molecular Formula C14H10Cl3N5O
Exact Mass 368.995093 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6OW3KRv2CYs
Name 6-benzyloxy-9-(1,2,2-trichlorovinyl)purin-2-amine
Alternate Name(s) 6-phenylmethoxy-9-(1,2,2-trichloroethenyl)-2-purinamine 6-phenylmethoxy-9-(1,2,2-trichloroethenyl)purin-2-amine 6-phenylmethoxy-9-[1,2,2-tris(chloranyl)ethenyl]purin-2-amine [6-benzoxy-9-(1,2,2-trichlorovinyl)purin-2-yl]amine
Comments Less than 3 mono-isotopic peaks
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Formula C14H10Cl3N5O
InChI InChI=1S/C14H10Cl3N5O/c15-10(16)11(17)22-7-19-9-12(22)20-14(18)21-13(9)23-6-8-4-2-1-3-5-8/h1-5,7H,6H2,(H2,18,20,21)
InChIKey AMJWYSOJJZHJOK-UHFFFAOYSA-N
Molecular Weight 370.627 g/mol
SMILES Nc1nc(c2c([n](C(=C(Cl)Cl)Cl)cn2)n1)OCc1ccccc1
SPLASH splash10-0006-9005000000-1d93fdaaf3757e61af2e
Source of Spectrum KC-0-1095-13
Wiley ID 781245