CID 15390519

Diethyl n-(3-(trimethoxysilyl)propyl)aspartate

Structural Information

Molecular Formula
C14H29NO7Si
SMILES
CCOC(=O)C[C@@H](C(=O)OCC)NCCC[Si](OC)(OC)OC
InChI
InChI=1S/C14H29NO7Si/c1-6-21-13(16)11-12(14(17)22-7-2)15-9-8-10-23(18-3,19-4)20-5/h12,15H,6-11H2,1-5H3/t12-/m0/s1
InChIKey
VSNLCLFPPHBFLV-LBPRGKRZSA-N
Compound name
diethyl (2S)-2-(3-trimethoxysilylpropylamino)butanedioate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

271
Patents

351.17133 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 352.17861 181.6
[M+Na]+ 374.16055 184.1
[M-H]- 350.16405 180.5
[M+NH4]+ 369.20515 199.9
[M+K]+ 390.13449 186.0
[M+H-H2O]+ 334.16859 174.7
[M+HCOO]- 396.16953 203.8
[M+CH3COO]- 410.18518 213.1
[M+Na-2H]- 372.14600 182.0
[M]+ 351.17078 191.7
[M]- 351.17188 191.7
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

patents stripe