CID 118497

Triethoxysilylpropylmaleamic acid

Structural Information

Molecular Formula
C13H25NO6Si
SMILES
CCO[Si](CCCNC(=O)C=CC(=O)O)(OCC)OCC
InChI
InChI=1S/C13H25NO6Si/c1-4-18-21(19-5-2,20-6-3)11-7-10-14-12(15)8-9-13(16)17/h8-9H,4-7,10-11H2,1-3H3,(H,14,15)(H,16,17)
InChIKey
YSIBYEBNVMDAPN-UHFFFAOYSA-N
Compound name
4-oxo-4-(3-triethoxysilylpropylamino)but-2-enoic acid
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

3297
Patents

319.1451 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 320.15238 173.9
[M+Na]+ 342.13432 177.0
[M-H]- 318.13782 171.5
[M+NH4]+ 337.17892 187.6
[M+K]+ 358.10826 176.5
[M+H-H2O]+ 302.14236 167.5
[M+HCOO]- 364.14330 193.0
[M+CH3COO]- 378.15895 203.9
[M+Na-2H]- 340.11977 175.2
[M]+ 319.14455 180.1
[M]- 319.14565 180.1
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