CID 13065

2,2-diphenylpropane

Structural Information

Molecular Formula
C15H16
SMILES
CC(C)(C1=CC=CC=C1)C2=CC=CC=C2
InChI
InChI=1S/C15H16/c1-15(2,13-9-5-3-6-10-13)14-11-7-4-8-12-14/h3-12H,1-2H3
InChIKey
MILSYCKGLDDVLM-UHFFFAOYSA-N
Compound name
2-phenylpropan-2-ylbenzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

10754
Patents

196.1252 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 197.13248 144.0
[M+Na]+ 219.11442 150.8
[M-H]- 195.11792 150.5
[M+NH4]+ 214.15902 163.1
[M+K]+ 235.08836 147.0
[M+H-H2O]+ 179.12246 137.3
[M+HCOO]- 241.12340 166.5
[M+CH3COO]- 255.13905 185.6
[M+Na-2H]- 217.09987 152.3
[M]+ 196.12465 143.0
[M]- 196.12575 143.0
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