CID 2763176

4-(chloromethyl)-1-trityl-1h-imidazole

Structural Information

Molecular Formula
C23H19ClN2
SMILES
C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)N4C=C(N=C4)CCl
InChI
InChI=1S/C23H19ClN2/c24-16-22-17-26(18-25-22)23(19-10-4-1-5-11-19,20-12-6-2-7-13-20)21-14-8-3-9-15-21/h1-15,17-18H,16H2
InChIKey
ADCUCAMWCWNHJA-UHFFFAOYSA-N
Compound name
4-(chloromethyl)-1-tritylimidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

261
Patents

358.1237 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 359.13098 187.4
[M+Na]+ 381.11292 194.6
[M-H]- 357.11642 196.6
[M+NH4]+ 376.15752 198.7
[M+K]+ 397.08686 185.9
[M+H-H2O]+ 341.12096 175.9
[M+HCOO]- 403.12190 202.7
[M+CH3COO]- 417.13755 197.1
[M+Na-2H]- 379.09837 191.5
[M]+ 358.12315 187.9
[M]- 358.12425 187.9
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

patents stripe