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Cytidine, N-acetyl-N-methyl-, 2',3',5'-triacetate
SpectraBase Compound ID 6INHj1MCETP
InChI InChI=1S/C18H23N3O9/c1-9(22)20(5)14-6-7-21(18(26)19-14)17-16(29-12(4)25)15(28-11(3)24)13(30-17)8-27-10(2)23/h6-7,13,15-17H,8H2,1-5H3/t13-,15-,16-,17-/m1/s1
InChIKey IFRXNYVWHSPIKM-MWQQHZPXSA-N
Mol Weight 425.39 g/mol
Molecular Formula C18H23N3O9
Exact Mass 425.143429 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID vePuLHKppu
Name Cytidine, N-acetyl-N-methyl-, 2',3',5'-triacetate
Alternate Name(s) N6-diacetyl-2',3',5'-tri-O-acetylcytidine [(2R,3R,4R,5R)-3,4-bis(acetyloxy)-5-[4-(N-methylacetamido)-2-oxo-1,2-dihydropyrimidin-1-yl]oxolan-2-yl]methyl acetate
CAS Registry Number 55760-29-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H23N3O9
InChI InChI=1S/C18H23N3O9/c1-9(22)20(5)14-6-7-21(18(26)19-14)17-16(29-12(4)25)15(28-11(3)24)13(30-17)8-27-10(2)23/h6-7,13,15-17H,8H2,1-5H3/t13-,15-,16-,17-/m1/s1
InChIKey IFRXNYVWHSPIKM-MWQQHZPXSA-N
Molecular Weight 425.394 g/mol
SMILES [C@@]1(N2C(N=C(C=C2)N(C(=O)C)C)=O)([C@@]([C@](OC(=O)C)([C@](O1)(COC(=O)C)[H])[H])(OC(=O)C)[H])[H]
SPLASH splash10-05n1-4930000000-b1ed29b7b4ba9b4341bc
Source of Spectrum KO-1-46-416
Wiley ID 1379600