CID 396151

Nsc701699

Structural Information

Molecular Formula
C17H27N3O5Si
SMILES
CC(C)(C)[Si](C)(C)OC1C(C(OC1N2C=CC(=O)NC2=O)CO)CC#N
InChI
InChI=1S/C17H27N3O5Si/c1-17(2,3)26(4,5)25-14-11(6-8-18)12(10-21)24-15(14)20-9-7-13(22)19-16(20)23/h7,9,11-12,14-15,21H,6,10H2,1-5H3,(H,19,22,23)
InChIKey
QZNREPIHKFNWON-UHFFFAOYSA-N
Compound name
2-[4-[tert-butyl(dimethyl)silyl]oxy-5-(2,4-dioxopyrimidin-1-yl)-2-(hydroxymethyl)oxolan-3-yl]acetonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

381.172 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 382.17928 188.4
[M+Na]+ 404.16122 196.5
[M-H]- 380.16472 189.4
[M+NH4]+ 399.20582 196.3
[M+K]+ 420.13516 194.0
[M+H-H2O]+ 364.16926 174.4
[M+HCOO]- 426.17020 197.7
[M+CH3COO]- 440.18585 221.1
[M+Na-2H]- 402.14667 188.3
[M]+ 381.17145 185.3
[M]- 381.17255 185.3
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.