CID 11078078

114676-67-4

Structural Information

Molecular Formula
C16H33NO4Si
SMILES
CC(C)(C)OC(=O)N1C[C@@H](C[C@H]1CO)O[Si](C)(C)C(C)(C)C
InChI
InChI=1S/C16H33NO4Si/c1-15(2,3)20-14(19)17-10-13(9-12(17)11-18)21-22(7,8)16(4,5)6/h12-13,18H,9-11H2,1-8H3/t12-,13+/m0/s1
InChIKey
IIITUHPEBILIQR-QWHCGFSZSA-N
Compound name
tert-butyl (2S,4R)-4-[tert-butyl(dimethyl)silyl]oxy-2-(hydroxymethyl)pyrrolidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

310
Patents

331.2179 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 332.22518 180.5
[M+Na]+ 354.20712 185.0
[M-H]- 330.21062 180.9
[M+NH4]+ 349.25172 195.6
[M+K]+ 370.18106 184.6
[M+H-H2O]+ 314.21516 175.9
[M+HCOO]- 376.21610 192.8
[M+CH3COO]- 390.23175 205.6
[M+Na-2H]- 352.19257 181.3
[M]+ 331.21735 183.3
[M]- 331.21845 183.3
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

patents stripe