CID 12424

Tetraphenylmethane

Structural Information

Molecular Formula
C25H20
SMILES
C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C25H20/c1-5-13-21(14-6-1)25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24/h1-20H
InChIKey
PEQHIRFAKIASBK-UHFFFAOYSA-N
Compound name
tritylbenzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

21
References

2789
Patents

320.1565 Da
Monoisotopic Mass

7.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 321.16378 178.7
[M+Na]+ 343.14572 183.5
[M-H]- 319.14922 189.9
[M+NH4]+ 338.19032 191.0
[M+K]+ 359.11966 176.1
[M+H-H2O]+ 303.15376 168.2
[M+HCOO]- 365.15470 199.8
[M+CH3COO]- 379.17035 188.8
[M+Na-2H]- 341.13117 185.9
[M]+ 320.15595 175.1
[M]- 320.15705 175.1
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