CID 10754405

Benzenediamine, n-(1,3-dimethylbutyl)-n'-phenyl-

Structural Information

Molecular Formula
C18H24N2
SMILES
CC(C)CC(C)NC1=CC=CC=C1NC2=CC=CC=C2
InChI
InChI=1S/C18H24N2/c1-14(2)13-15(3)19-17-11-7-8-12-18(17)20-16-9-5-4-6-10-16/h4-12,14-15,19-20H,13H2,1-3H3
InChIKey
QYMKLPYJMOMVNV-UHFFFAOYSA-N
Compound name
2-N-(4-methylpentan-2-yl)-1-N-phenylbenzene-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

359
Patents

268.19394 Da
Monoisotopic Mass

5.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.20122 168.1
[M+Na]+ 291.18316 180.3
[M+NH4]+ 286.22776 176.8
[M+K]+ 307.15710 172.1
[M-H]- 267.18666 174.2
[M+Na-2H]- 289.16861 177.1
[M]+ 268.19339 171.6
[M]- 268.19449 171.6
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