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2-N-Allyl-2'-deoxyguanosine
SpectraBase Compound ID 11RUcHXpzDX
InChI InChI=1S/C13H17N5O4/c1-2-3-14-13-16-11-10(12(21)17-13)15-6-18(11)9-4-7(20)8(5-19)22-9/h2,6-9,19-20H,1,3-5H2,(H2,14,16,17,21)/t7-,8+,9+/m0/s1
InChIKey ONRYJGACOXCYKJ-DJLDLDEBSA-N
Mol Weight 307.31 g/mol
Molecular Formula C13H17N5O4
Exact Mass 307.128054 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7BirTmVUae9
Name 2-N-Allyl-2'-deoxyguanosine
Alternate Name(s) 9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-(prop-2-en-1-ylamino)-6,9-dihydro-1H-purin-6-one
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Formula C13H17N5O4
InChI InChI=1S/C13H17N5O4/c1-2-3-14-13-16-11-10(12(21)17-13)15-6-18(11)9-4-7(20)8(5-19)22-9/h2,6-9,19-20H,1,3-5H2,(H2,14,16,17,21)/t7-,8+,9+/m0/s1
InChIKey ONRYJGACOXCYKJ-DJLDLDEBSA-N
Molecular Weight 307.310 g/mol
SMILES Oc1c2c([n]([C@]3(C[C@@]([C@](O3)(CO)[H])(O)[H])[H])cn2)nc(n1)NCC=C
SPLASH splash10-001r-9300000000-48ba6e2bc42439592503
Source of Spectrum KC-0-1891-10
Wiley ID 822746