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N(6),n(6),o-2',3',5'-penta(methyl-D3)adenosine

View entire compound with spectra: 2 MS (GC)

N(6),n(6),o-2',3',5'-penta(methyl-D3)adenosine
SpectraBase Compound ID Cw9SuS5zivg
InChI InChI=1S/C15H23N5O4/c1-19(2)13-10-14(17-7-16-13)20(8-18-10)15-12(23-5)11(22-4)9(24-15)6-21-3/h7-9,11-12,15H,6H2,1-5H3/t9-,11-,12-,15-/m1/s1/i1D3,2D3,3D3,4D3,5D3
InChIKey YXMRAWLSVCPKRV-AKRLCFCKSA-N
Mol Weight 352.47 g/mol
Molecular Formula C15H8D15N5O4
Exact Mass 352.269155 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J0E0vgZXgGj
Name N(6),n(6),o-2',3',5'-penta(methyl-D3)adenosine
Alternate Name(s) N(6),N(6),O(2'),O(3'),O(5')-[Penta(trideuterio)methyl]-adenosine
CAS Registry Number 50826-74-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H8D15N5O4
InChI InChI=1S/C15H23N5O4/c1-19(2)13-10-14(17-7-16-13)20(8-18-10)15-12(23-5)11(22-4)9(24-15)6-21-3/h7-9,11-12,15H,6H2,1-5H3/t9-,11-,12-,15-/m1/s1/i1D3,2D3,3D3,4D3,5D3
InChIKey YXMRAWLSVCPKRV-AKRLCFCKSA-N
Molecular Weight 352.472 g/mol
SMILES [C@@]1([n]2c3c(c(N(C([D])([D])[D])C([D])([D])[D])ncn3)nc2)([C@@]([C@](OC([D])([D])[D])([C@](O1)(COC([D])([D])[D])[H])[H])(OC([D])([D])[D])[H])[H]
SPLASH splash10-00ds-1901000000-8320a4e44aab128614eb
Source of Spectrum W-0-1-539
Wiley ID 754103