CID 10488231

75867-40-2

Structural Information

Molecular Formula
C12H13NSi
SMILES
C[Si](C)(C)C#CC1=CC=C(C=C1)C#N
InChI
InChI=1S/C12H13NSi/c1-14(2,3)9-8-11-4-6-12(10-13)7-5-11/h4-7H,1-3H3
InChIKey
WWNSLIBJQBBKKG-UHFFFAOYSA-N
Compound name
4-(2-trimethylsilylethynyl)benzonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

38
Patents

199.08173 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 200.08901 167.2
[M+Na]+ 222.07095 176.5
[M+NH4]+ 217.11555 168.3
[M+K]+ 238.04489 165.6
[M-H]- 198.07445 157.1
[M+Na-2H]- 220.05640 167.0
[M]+ 199.08118 164.6
[M]- 199.08228 164.6
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