CID 26482

1,2-diphenylethylamine

Structural Information

Molecular Formula
C14H15N
SMILES
C1=CC=C(C=C1)CC(C2=CC=CC=C2)N
InChI
InChI=1S/C14H15N/c15-14(13-9-5-2-6-10-13)11-12-7-3-1-4-8-12/h1-10,14H,11,15H2
InChIKey
DTGGNTMERRTPLR-UHFFFAOYSA-N
Compound name
1,2-diphenylethanamine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

4
References

1030
Patents

197.12045 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.12773 144.4
[M+Na]+ 220.10967 149.9
[M-H]- 196.11317 150.2
[M+NH4]+ 215.15427 162.6
[M+K]+ 236.08361 146.0
[M+H-H2O]+ 180.11771 137.1
[M+HCOO]- 242.11865 168.2
[M+CH3COO]- 256.13430 187.1
[M+Na-2H]- 218.09512 150.7
[M]+ 197.11990 141.1
[M]- 197.12100 141.1
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