CID 211060

2-(4-aminophenyl)-2-phenylpropanenitrile

Structural Information

Molecular Formula
C15H14N2
SMILES
CC(C#N)(C1=CC=CC=C1)C2=CC=C(C=C2)N
InChI
InChI=1S/C15H14N2/c1-15(11-16,12-5-3-2-4-6-12)13-7-9-14(17)10-8-13/h2-10H,17H2,1H3
InChIKey
FXDPMMRRRJRSLY-UHFFFAOYSA-N
Compound name
2-(4-aminophenyl)-2-phenylpropanenitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

222.11569 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 223.12297 159.6
[M+Na]+ 245.10491 168.8
[M-H]- 221.10841 164.5
[M+NH4]+ 240.14951 175.2
[M+K]+ 261.07885 162.8
[M+H-H2O]+ 205.11295 146.1
[M+HCOO]- 267.11389 178.6
[M+CH3COO]- 281.12954 203.1
[M+Na-2H]- 243.09036 164.9
[M]+ 222.11514 152.0
[M]- 222.11624 152.0
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