CID 24822235

4-{[2-(hydroxymethyl)phenyl]dimethylsilyl}benzonitrile

Structural Information

Molecular Formula
C16H17NOSi
SMILES
C[Si](C)(C1=CC=C(C=C1)C#N)C2=CC=CC=C2CO
InChI
InChI=1S/C16H17NOSi/c1-19(2,15-9-7-13(11-17)8-10-15)16-6-4-3-5-14(16)12-18/h3-10,18H,12H2,1-2H3
InChIKey
XWMSORGQYGQYPY-UHFFFAOYSA-N
Compound name
4-[[2-(hydroxymethyl)phenyl]-dimethylsilyl]benzonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

267.10794 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 268.11522 167.3
[M+Na]+ 290.09716 176.9
[M-H]- 266.10066 171.5
[M+NH4]+ 285.14176 182.0
[M+K]+ 306.07110 170.6
[M+H-H2O]+ 250.10520 154.0
[M+HCOO]- 312.10614 184.2
[M+CH3COO]- 326.12179 205.3
[M+Na-2H]- 288.08261 171.2
[M]+ 267.10739 161.9
[M]- 267.10849 161.9
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.