CID 9578746

Nsc701721

Structural Information

Molecular Formula
C17H29N3O6Si
SMILES
CC(C)(C)[Si](C)(C)OC[C@H]1C(C[C@H](O1)N2C=CC(=O)NC2=O)(C/C=N/O)O
InChI
InChI=1S/C17H29N3O6Si/c1-16(2,3)27(4,5)25-11-12-17(23,7-8-18-24)10-14(26-12)20-9-6-13(21)19-15(20)22/h6,8-9,12,14,23-24H,7,10-11H2,1-5H3,(H,19,21,22)/b18-8+/t12-,14-,17?/m0/s1
InChIKey
JEGKVFZVDLUHHG-AHQLVEPXSA-N
Compound name
1-[(2S,5S)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-hydroxy-4-[(2E)-2-hydroxyiminoethyl]oxolan-2-yl]pyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

399.18256 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 400.18984 190.3
[M+Na]+ 422.17178 196.4
[M-H]- 398.17528 192.6
[M+NH4]+ 417.21638 200.4
[M+K]+ 438.14572 194.8
[M+H-H2O]+ 382.17982 183.9
[M+HCOO]- 444.18076 204.0
[M+CH3COO]- 458.19641 215.3
[M+Na-2H]- 420.15723 194.1
[M]+ 399.18201 193.2
[M]- 399.18311 193.2
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.