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(E)-2-Amino-6-chloro-9-((2-Hydroxymethyl)cyclopropylidene)methyl)purine
SpectraBase Compound ID 3Xo1TgpPXQQ
InChI InChI=1S/C10H10ClN5O/c11-8-7-9(15-10(12)14-8)16(4-13-7)2-5-1-6(5)3-17/h2,4,6,17H,1,3H2,(H2,12,14,15)/b5-2+
InChIKey KKBVYTNBEFLMBF-GORDUTHDSA-N
Mol Weight 251.68 g/mol
Molecular Formula C10H10ClN5O
Exact Mass 251.057388 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4TBV1sIcPIO
Name (E)-2-Amino-6-chloro-9-((2-Hydroxymethyl)cyclopropylidene)methyl)purine
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Formula C10H10ClN5O
InChI InChI=1S/C10H10ClN5O/c11-8-7-9(15-10(12)14-8)16(4-13-7)2-5-1-6(5)3-17/h2,4,6,17H,1,3H2,(H2,12,14,15)/b5-2+
InChIKey KKBVYTNBEFLMBF-GORDUTHDSA-N
Molecular Weight 251.677 g/mol
SMILES OCC1C\C1=C/[n]1c2c(c(nc(n2)N)Cl)nc1
SPLASH splash10-00e9-0790000000-aa1a05ba044e58fd3ca5
Source of Spectrum F2-41-19-34
Synonyms [(2E)-2-[(2-amino-6-chloro-9-purinyl)methylidene]cyclopropyl]methanol [(2E)-2-[(2-amino-6-chloropurin-9-yl)methylidene]cyclopropyl]methanol [(2E)-2-[(2-azanyl-6-chloranyl-purin-9-yl)methylidene]cyclopropyl]methanol
Wiley ID 1599475