CID 465320

Chembl2110179

Structural Information

Molecular Formula
C15H25F2N3O4Si
SMILES
CC(C)(C)[Si](C)(C)O[C@H]1[C@@H](O[C@@H](C1(F)F)N2C=CC(=NC2=O)N)CO
InChI
InChI=1S/C15H25F2N3O4Si/c1-14(2,3)25(4,5)24-11-9(8-21)23-12(15(11,16)17)20-7-6-10(18)19-13(20)22/h6-7,9,11-12,21H,8H2,1-5H3,(H2,18,19,22)/t9-,11-,12-/m0/s1
InChIKey
MAKBJUIOPCTFNB-DLOVCJGASA-N
Compound name
4-amino-1-[(2S,4S,5S)-4-[tert-butyl(dimethyl)silyl]oxy-3,3-difluoro-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

377.15823 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 378.16551 183.8
[M+Na]+ 400.14745 192.3
[M-H]- 376.15095 185.0
[M+NH4]+ 395.19205 195.8
[M+K]+ 416.12139 190.4
[M+H-H2O]+ 360.15549 176.1
[M+HCOO]- 422.15643 196.3
[M+CH3COO]- 436.17208 215.2
[M+Na-2H]- 398.13290 185.6
[M]+ 377.15768 183.7
[M]- 377.15878 183.7
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.