For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
N(6),o-2',3',5'-tetra(methyl-D3)-N(6)-(3-methyl-2-butenyl)adenosine
SpectraBase Compound ID 9KUP64gZdef
InChI InChI=1S/C19H29N5O4/c1-12(2)7-8-23(3)17-14-18(21-10-20-17)24(11-22-14)19-16(27-6)15(26-5)13(28-19)9-25-4/h7,10-11,13,15-16,19H,8-9H2,1-6H3/t13-,15-,16-,19-/m1/s1/i3D3,4D3,5D3,6D3
InChIKey SYMFHGKCPKOLJM-OPQIVCARSA-N
Mol Weight 403.55 g/mol
Molecular Formula C19H172D12N5O4
Exact Mass 403.297275 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID QI5bY02wi
Name N(6),o-2',3',5'-tetra(methyl-D3)-N(6)-(3-methyl-2-butenyl)adenosine
CAS Registry Number 50826-82-9
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H17D12N5O4
InChI InChI=1S/C19H29N5O4/c1-12(2)7-8-23(3)17-14-18(21-10-20-17)24(11-22-14)19-16(27-6)15(26-5)13(28-19)9-25-4/h7,10-11,13,15-16,19H,8-9H2,1-6H3/t13-,15-,16-,19-/m1/s1/i3D3,4D3,5D3,6D3
InChIKey SYMFHGKCPKOLJM-OPQIVCARSA-N
Molecular Weight 403.545 g/mol
SMILES [C@@]1([n]2c3c(c(N(CC=C(C)C)C([2D])([2D])[2D])ncn3)nc2)([C@@]([C@](OC([2D])([2D])[2D])([C@](O1)(COC([2D])([2D])[2D])[H])[H])(OC([2D])([2D])[2D])[H])[H]
SPLASH splash10-1090-4971200000-24d754ee234783281925
Source of Spectrum C-95-7484-5
Wiley ID 1365306