CID 209832

20556-57-4

Structural Information

Molecular Formula
C21H35NO3Si
SMILES
CN(C)CCOC(=O)C(C1=CC=C(C=C1)[Si](C)(C)C)C2(CCCCC2)O
InChI
InChI=1S/C21H35NO3Si/c1-22(2)15-16-25-20(23)19(21(24)13-7-6-8-14-21)17-9-11-18(12-10-17)26(3,4)5/h9-12,19,24H,6-8,13-16H2,1-5H3
InChIKey
AUYUJACOVITNLL-UHFFFAOYSA-N
Compound name
2-(dimethylamino)ethyl 2-(1-hydroxycyclohexyl)-2-(4-trimethylsilylphenyl)acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

377.23862 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 378.24590 192.6
[M+Na]+ 400.22784 193.3
[M-H]- 376.23134 197.2
[M+NH4]+ 395.27244 206.2
[M+K]+ 416.20178 192.0
[M+H-H2O]+ 360.23588 185.2
[M+HCOO]- 422.23682 207.1
[M+CH3COO]- 436.25247 220.4
[M+Na-2H]- 398.21329 191.8
[M]+ 377.23807 191.5
[M]- 377.23917 191.5
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.