CID 110695

1,2-diphenylethane-1,2-diamine

Structural Information

Molecular Formula
C14H16N2
SMILES
C1=CC=C(C=C1)C(C(C2=CC=CC=C2)N)N
InChI
InChI=1S/C14H16N2/c15-13(11-7-3-1-4-8-11)14(16)12-9-5-2-6-10-12/h1-10,13-14H,15-16H2
InChIKey
PONXTPCRRASWKW-UHFFFAOYSA-N
Compound name
1,2-diphenylethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

76
References

4238
Patents

212.13135 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.13863 150.3
[M+Na]+ 235.12057 162.4
[M+NH4]+ 230.16517 159.3
[M+K]+ 251.09451 155.4
[M-H]- 211.12407 156.1
[M+Na-2H]- 233.10602 159.6
[M]+ 212.13080 153.6
[M]- 212.13190 153.6
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