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(+-)-cis-2-{[2-Amino-6-chloro-5-(4-chlorophenylazoyl)-4-pyrimidinyl]amino}-3-cyclopentenylmethanol
SpectraBase Compound ID GosgJ3fDnPB
InChI InChI=1S/C16H16Cl2N6O/c17-10-4-6-11(7-5-10)23-24-13-14(18)21-16(19)22-15(13)20-12-3-1-2-9(12)8-25/h1,3-7,9,12,25H,2,8H2,(H3,19,20,21,22)/b24-23+/t9-,12-/m0/s1
InChIKey XGBYIOCRVGLTIV-GMJKQPIWSA-N
Mol Weight 379.25 g/mol
Molecular Formula C16H16Cl2N6O
Exact Mass 378.076265 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 89W4PhQMsxH
Name (+-)-cis-2-{[2-Amino-6-chloro-5-(4-chlorophenylazoyl)-4-pyrimidinyl]amino}-3-cyclopentenylmethanol
Alternate Name(s) (+-)-cis-2-{[2-Amino-6-chloro-5-(4-chlorophenylazo)-4-pyrimidinyl]amino}-3-cyclopentenylmethanol [(1R,2S)-2-({2-amino-6-chloro-5-[(E)-(4-chlorophenyl)diazenyl]-4-pyrimidinyl}amino)-3-cyclopenten-1-yl]methanol
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Formula C16H16Cl2N6O
InChI InChI=1S/C16H16Cl2N6O/c17-10-4-6-11(7-5-10)23-24-13-14(18)21-16(19)22-15(13)20-12-3-1-2-9(12)8-25/h1,3-7,9,12,25H,2,8H2,(H3,19,20,21,22)/b24-23+/t9-,12-/m0/s1
InChIKey XGBYIOCRVGLTIV-GMJKQPIWSA-N
Molecular Weight 379.251 g/mol
SMILES Nc1nc(c(c(n1)Cl)\N=N\c1ccc(cc1)Cl)N[C@@]1([C@](CO)(CC=C1)[H])[H]
SPLASH splash10-0w90-3390000000-85324ffb9e00ed474bc8
Source of Spectrum CV-20-2448-7
Wiley ID 1610440