CID 109028

Benzamide, 4-nitro-n-[3-(triethoxysilyl)propyl]-

Structural Information

Molecular Formula
C16H26N2O6Si
SMILES
CCO[Si](CCCNC(=O)C1=CC=C(C=C1)[N+](=O)[O-])(OCC)OCC
InChI
InChI=1S/C16H26N2O6Si/c1-4-22-25(23-5-2,24-6-3)13-7-12-17-16(19)14-8-10-15(11-9-14)18(20)21/h8-11H,4-7,12-13H2,1-3H3,(H,17,19)
InChIKey
NMWDYCNYWCIATE-UHFFFAOYSA-N
Compound name
4-nitro-N-(3-triethoxysilylpropyl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

428
Patents

370.156 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 371.16328 186.1
[M+Na]+ 393.14522 188.6
[M-H]- 369.14872 188.5
[M+NH4]+ 388.18982 197.5
[M+K]+ 409.11916 183.6
[M+H-H2O]+ 353.15326 182.5
[M+HCOO]- 415.15420 208.4
[M+CH3COO]- 429.16985 210.4
[M+Na-2H]- 391.13067 191.2
[M]+ 370.15545 190.7
[M]- 370.15655 190.7
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