CID 70602

2-oxa-7,10-diaza-3-silatridecan-13-oic acid, 3,3-dimethoxy-, methyl ester

Structural Information

Molecular Formula
C12H28N2O5Si
SMILES
COC(=O)CCNCCNCCC[Si](OC)(OC)OC
InChI
InChI=1S/C12H28N2O5Si/c1-16-12(15)6-8-14-10-9-13-7-5-11-20(17-2,18-3)19-4/h13-14H,5-11H2,1-4H3
InChIKey
IKUCSZCOPRPNOY-UHFFFAOYSA-N
Compound name
methyl 3-[2-(3-trimethoxysilylpropylamino)ethylamino]propanoate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

273
Patents

308.17676 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 309.18404 172.3
[M+Na]+ 331.16598 174.9
[M-H]- 307.16948 171.2
[M+NH4]+ 326.21058 187.0
[M+K]+ 347.13992 175.7
[M+H-H2O]+ 291.17402 165.2
[M+HCOO]- 353.17496 194.5
[M+CH3COO]- 367.19061 208.0
[M+Na-2H]- 329.15143 176.0
[M]+ 308.17621 179.9
[M]- 308.17731 179.9
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