CID 496601

Nsc694921

Structural Information

Molecular Formula
C17H30N4O6Si
SMILES
CC1=CN(C(=O)NC1=O)[C@H]2C[C@H]([C@H](O2)CO[Si](C)(C)C(C)(C)C)ONC(=O)N
InChI
InChI=1S/C17H30N4O6Si/c1-10-8-21(16(24)19-14(10)22)13-7-11(27-20-15(18)23)12(26-13)9-25-28(5,6)17(2,3)4/h8,11-13H,7,9H2,1-6H3,(H3,18,20,23)(H,19,22,24)/t11-,12-,13-/m1/s1
InChIKey
FCINUMFHKUBJAV-JHJVBQTASA-N
Compound name
[(2R,3R,5R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl]oxyurea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

414.19345 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 415.20073 196.1
[M+Na]+ 437.18267 201.3
[M-H]- 413.18617 199.5
[M+NH4]+ 432.22727 203.7
[M+K]+ 453.15661 200.5
[M+H-H2O]+ 397.19071 188.4
[M+HCOO]- 459.19165 210.6
[M+CH3COO]- 473.20730 225.4
[M+Na-2H]- 435.16812 196.5
[M]+ 414.19290 198.4
[M]- 414.19400 198.4
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.