CID 460316

N^4-dimethylamino-3'-azido-2',3'-dideoxycytidine

Structural Information

Molecular Formula
C11H17N7O3
SMILES
CN(C)NC1=NC(=O)N(C=C1)[C@H]2C[C@@H]([C@H](O2)CO)N=[N+]=[N-]
InChI
InChI=1S/C11H17N7O3/c1-17(2)15-9-3-4-18(11(20)13-9)10-5-7(14-16-12)8(6-19)21-10/h3-4,7-8,10,19H,5-6H2,1-2H3,(H,13,15,20)/t7-,8+,10+/m0/s1
InChIKey
HURXCJPGRZOXSZ-QXFUBDJGSA-N
Compound name
1-[(2R,4S,5S)-4-azido-5-(hydroxymethyl)oxolan-2-yl]-4-(2,2-dimethylhydrazinyl)pyrimidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

295.13928 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.14656 164.0
[M+Na]+ 318.12850 169.2
[M-H]- 294.13200 171.8
[M+NH4]+ 313.17310 176.3
[M+K]+ 334.10244 164.1
[M+H-H2O]+ 278.13654 158.3
[M+HCOO]- 340.13748 191.9
[M+CH3COO]- 354.15313 210.0
[M+Na-2H]- 316.11395 172.1
[M]+ 295.13873 161.9
[M]- 295.13983 161.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.