CID 70545

P-trimethylsiloxynitrobenzene

Structural Information

Molecular Formula
C9H13NO3Si
SMILES
C[Si](C)(C)OC1=CC=C(C=C1)[N+](=O)[O-]
InChI
InChI=1S/C9H13NO3Si/c1-14(2,3)13-9-6-4-8(5-7-9)10(11)12/h4-7H,1-3H3
InChIKey
OJKNCYVKEUNYAX-UHFFFAOYSA-N
Compound name
trimethyl-(4-nitrophenoxy)silane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

53
Patents

211.06647 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.07375 142.6
[M+Na]+ 234.05569 149.8
[M-H]- 210.05919 146.6
[M+NH4]+ 229.10029 161.5
[M+K]+ 250.02963 144.9
[M+H-H2O]+ 194.06373 141.7
[M+HCOO]- 256.06467 166.7
[M+CH3COO]- 270.08032 179.3
[M+Na-2H]- 232.04114 151.4
[M]+ 211.06592 143.2
[M]- 211.06702 143.2
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