CID 84892

15396-00-6

Structural Information

Molecular Formula
C7H15NO4Si
SMILES
CO[Si](CCCN=C=O)(OC)OC
InChI
InChI=1S/C7H15NO4Si/c1-10-13(11-2,12-3)6-4-5-8-7-9/h4-6H2,1-3H3
InChIKey
FMGBDYLOANULLW-UHFFFAOYSA-N
Compound name
3-isocyanatopropyl(trimethoxy)silane
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

8
References

18020
Patents

205.07704 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.08432 141.8
[M+Na]+ 228.06626 148.7
[M-H]- 204.06976 143.3
[M+NH4]+ 223.11086 162.0
[M+K]+ 244.04020 149.9
[M+H-H2O]+ 188.07430 136.4
[M+HCOO]- 250.07524 167.3
[M+CH3COO]- 264.09089 186.7
[M+Na-2H]- 226.05171 149.4
[M]+ 205.07649 148.9
[M]- 205.07759 148.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe