CID 86272

1,3-benzenediamine, n1,6-bis(1,1-dimethylethyl)-4-methyl-

Structural Information

Molecular Formula
C15H26N2
SMILES
CC1=CC(=C(C=C1N)NC(C)(C)C)C(C)(C)C
InChI
InChI=1S/C15H26N2/c1-10-8-11(14(2,3)4)13(9-12(10)16)17-15(5,6)7/h8-9,17H,16H2,1-7H3
InChIKey
OASWMXZSDYLPOU-UHFFFAOYSA-N
Compound name
3-N,4-ditert-butyl-6-methylbenzene-1,3-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

234.2096 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 235.21688 160.4
[M+Na]+ 257.19882 170.8
[M+NH4]+ 252.24342 168.0
[M+K]+ 273.17276 165.4
[M-H]- 233.20232 162.8
[M+Na-2H]- 255.18427 165.6
[M]+ 234.20905 162.6
[M]- 234.21015 162.6
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