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9-(5(E)-Chloro-5-deoxy-.beta.-D-erythro-pent-4-enofuranosyl)adenine
SpectraBase Compound ID CwiFRwm9Qjo
InChI InChI=1S/C10H10ClN5O3/c11-1-4-6(17)7(18)10(19-4)16-3-15-5-8(12)13-2-14-9(5)16/h1-3,6-7,10,17-18H,(H2,12,13,14)/b4-1+/t6?,7?,10-/m1/s1
InChIKey CHJNOSMDBFGGQH-DPVAIGAOSA-N
Mol Weight 283.68 g/mol
Molecular Formula C10H10ClN5O3
Exact Mass 283.047217 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4qOOYzIG7DS
Name 9-(5(E)-Chloro-5-deoxy-.beta.-D-erythro-pent-4-enofuranosyl)adenine
Alternate Name(s) 2-(6-amino-9H-purin-9-yl)-5-(chloromethylidene)oxolane-3,4-diol
CAS Registry Number 144494-06-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H10ClN5O3
InChI InChI=1S/C10H10ClN5O3/c11-1-4-6(17)7(18)10(19-4)16-3-15-5-8(12)13-2-14-9(5)16/h1-3,6-7,10,17-18H,(H2,12,13,14)/b4-1+/t6?,7?,10-/m1/s1
InChIKey CHJNOSMDBFGGQH-DPVAIGAOSA-N
Molecular Weight 283.675 g/mol
SMILES OC1C(\C(O[C@]1([n]1c2c(c(N)ncn2)nc1)[H])=C/Cl)O
SPLASH splash10-000i-0950000000-2b7d2616a0c44da85b11
Source of Spectrum J-58-116-8
Wiley ID 1286659