CID 21115636

N1,n4-bis[4-(tert-butyl)phenyl]benzene-1,4-diamine

Structural Information

Molecular Formula
C26H32N2
SMILES
CC(C)(C)C1=CC=C(C=C1)NC2=CC=C(C=C2)NC3=CC=C(C=C3)C(C)(C)C
InChI
InChI=1S/C26H32N2/c1-25(2,3)19-7-11-21(12-8-19)27-23-15-17-24(18-16-23)28-22-13-9-20(10-14-22)26(4,5)6/h7-18,27-28H,1-6H3
InChIKey
RHAQEUSTCCHDAB-UHFFFAOYSA-N
Compound name
1-N,4-N-bis(4-tert-butylphenyl)benzene-1,4-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

372.25656 Da
Monoisotopic Mass

8.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 373.263836 195.2
[M+Na]+ 395.245778 199.9
[M-H]- 371.249284 204.5
[M+NH4]+ 390.290383 206.9
[M+K]+ 411.219718 193.9
[M+H-H2O]+ 355.253820 185.8
[M+HCOO]- 417.254761 215.5
[M+CH3COO]- 431.270411 226.7
[M+Na-2H]- 393.231226 199.7
[M]+ 372.25601142 194.4
[M]- 372.25710858 194.4
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