CID 3057083

Brn 6065506

Structural Information

Molecular Formula
C17H28ClNOSi
SMILES
CCN(CC)CCO[Si]1(CCCCC1)C2=CC=C(C=C2)Cl
InChI
InChI=1S/C17H28ClNOSi/c1-3-19(4-2)12-13-20-21(14-6-5-7-15-21)17-10-8-16(18)9-11-17/h8-11H,3-7,12-15H2,1-2H3
InChIKey
KBNXTOJHEHCMNR-UHFFFAOYSA-N
Compound name
2-[1-(4-chlorophenyl)silinan-1-yl]oxy-N,N-diethylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

325.16287 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 326.17015 177.7
[M+Na]+ 348.15209 181.3
[M-H]- 324.15559 183.8
[M+NH4]+ 343.19669 195.2
[M+K]+ 364.12603 177.3
[M+H-H2O]+ 308.16013 170.1
[M+HCOO]- 370.16107 193.5
[M+CH3COO]- 384.17672 209.8
[M+Na-2H]- 346.13754 179.7
[M]+ 325.16232 178.6
[M]- 325.16342 178.6
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.