CID 2771754

1-(4-phenylphenyl)ethan-1-amine

Structural Information

Molecular Formula
C14H15N
SMILES
CC(C1=CC=C(C=C1)C2=CC=CC=C2)N
InChI
InChI=1S/C14H15N/c1-11(15)12-7-9-14(10-8-12)13-5-3-2-4-6-13/h2-11H,15H2,1H3
InChIKey
QVLZRPPCCDKMPO-UHFFFAOYSA-N
Compound name
1-(4-phenylphenyl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

91
Patents

197.12045 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.127726 144.3
[M+Na]+ 220.109668 150.8
[M-H]- 196.113174 150.5
[M+NH4]+ 215.154273 162.9
[M+K]+ 236.083608 146.9
[M+H-H2O]+ 180.117710 137.2
[M+HCOO]- 242.118651 168.1
[M+CH3COO]- 256.134301 188.2
[M+Na-2H]- 218.095116 149.8
[M]+ 197.11990142 141.5
[M]- 197.12099858 141.5
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