CID 58200

101198-12-3

Structural Information

Molecular Formula
C18H29NO5Si
SMILES
CC(COC1=CC=CC=C1)C(=O)OCCN2CCO[Si](OCC2)(C)C
InChI
InChI=1S/C18H29NO5Si/c1-16(15-22-17-7-5-4-6-8-17)18(20)21-12-9-19-10-13-23-25(2,3)24-14-11-19/h4-8,16H,9-15H2,1-3H3
InChIKey
ZIIDHPAOCIOQJO-UHFFFAOYSA-N
Compound name
2-(2,2-dimethyl-1,3,6,2-dioxazasilocan-6-yl)ethyl 2-methyl-3-phenoxypropanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

367.1815 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 368.18878 175.8
[M+Na]+ 390.17072 178.8
[M+NH4]+ 385.21532 177.8
[M+K]+ 406.14466 177.0
[M-H]- 366.17422 176.9
[M+Na-2H]- 388.15617 177.2
[M]+ 367.18095 176.5
[M]- 367.18205 176.5
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

No patent data available for this compound.