CID 4093514

N,n'-diethyl-n,n'-diphenylethylenediamine

Structural Information

Molecular Formula
C18H24N2
SMILES
CCN(CCN(CC)C1=CC=CC=C1)C2=CC=CC=C2
InChI
InChI=1S/C18H24N2/c1-3-19(17-11-7-5-8-12-17)15-16-20(4-2)18-13-9-6-10-14-18/h5-14H,3-4,15-16H2,1-2H3
InChIKey
GTIKMPFJLWCUCO-UHFFFAOYSA-N
Compound name
N,N'-diethyl-N,N'-diphenylethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

268.19394 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.20122 166.6
[M+Na]+ 291.18316 169.9
[M-H]- 267.18666 174.8
[M+NH4]+ 286.22776 183.0
[M+K]+ 307.15710 167.7
[M+H-H2O]+ 251.19120 157.2
[M+HCOO]- 313.19214 192.5
[M+CH3COO]- 327.20779 210.7
[M+Na-2H]- 289.16861 171.6
[M]+ 268.19339 168.0
[M]- 268.19449 168.0
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