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1H-Purine-2,8(3H,7H)-dione, 6-[(4-hydroxy-3-methyl-2-butenyl)amino]-, (E)-
SpectraBase Compound ID 3tpLbAvjI0l
InChI InChI=1S/C10H13N5O3/c1-5(4-16)2-3-11-7-6-8(14-9(17)12-6)15-10(18)13-7/h2,16H,3-4H2,1H3,(H4,11,12,13,14,15,17,18)/b5-2+
InChIKey OXVFKMPGBZNHQF-GORDUTHDSA-N
Mol Weight 251.25 g/mol
Molecular Formula C10H13N5O3
Exact Mass 251.101839 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KtdQOprBJXY
Name 1H-Purine-2,8(3H,7H)-dione, 6-[(4-hydroxy-3-methyl-2-butenyl)amino]-, (E)-
Alternate Name(s) 2,8-Dihydroxyzeatin 6-{[(2E)-4-hydroxy-3-methyl-2-butenyl]amino}-1H-purine-2,8(3H,7H)-dione
CAS Registry Number 57500-03-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H13N5O3
InChI InChI=1S/C10H13N5O3/c1-5(4-16)2-3-11-7-6-8(14-9(17)12-6)15-10(18)13-7/h2,16H,3-4H2,1H3,(H4,11,12,13,14,15,17,18)/b5-2+
InChIKey OXVFKMPGBZNHQF-GORDUTHDSA-N
Molecular Weight 251.246 g/mol
SMILES N(C1=C2C(=NC(=O)N2)NC(N1)=O)C\C=C\(CO)C
SPLASH splash10-014i-5900000000-39ff2a97a4c2628de30e
Source of Spectrum D-14-3091-4
Wiley ID 1254283