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N(6),o-2',3',5'-tetra(methyl-D3)-1-methyladenosine
SpectraBase Compound ID 5frF6yMpww0
InChI InChI=1S/C15H23N5O4/c1-8-18-13(16-2)10-14(19-8)20(7-17-10)15-12(23-5)11(22-4)9(24-15)6-21-3/h7,9,11-12,15H,6H2,1-5H3,(H,16,18,19)/t9-,11-,12-,15-/m1/s1/i2D3,3D3,4D3,5D3
InChIKey JVOLKMVVBGSFTK-QJQGLRRESA-N
Mol Weight 349.45 g/mol
Molecular Formula C15H112D12N5O4
Exact Mass 349.250325 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8ejs3oKHOma
Name N(6),o-2',3',5'-tetra(methyl-D3)-1-methyladenosine
CAS Registry Number 50826-84-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H11D12N5O4
InChI InChI=1S/C15H23N5O4/c1-8-18-13(16-2)10-14(19-8)20(7-17-10)15-12(23-5)11(22-4)9(24-15)6-21-3/h7,9,11-12,15H,6H2,1-5H3,(H,16,18,19)/t9-,11-,12-,15-/m1/s1/i2D3,3D3,4D3,5D3
InChIKey JVOLKMVVBGSFTK-QJQGLRRESA-N
Molecular Weight 349.453 g/mol
SMILES N(c1c2c([n]([C@]3([C@@]([C@](OC([2D])([2D])[2D])([C@](O3)(COC([2D])([2D])[2D])[H])[H])(OC([2D])([2D])[2D])[H])[H])cn2)nc(n1)C)C([2D])([2D])[2D]
SPLASH splash10-0002-6902000000-aa1967e781482ccac187
Source of Spectrum C-95-7483-4
Wiley ID 1332956