CID 3022736

93859-37-1

Structural Information

Molecular Formula
C19H26N2
SMILES
CCCC1=C(C(=CC(=C1)CC2=CC=C(C=C2)N)C(C)C)N
InChI
InChI=1S/C19H26N2/c1-4-5-16-11-15(12-18(13(2)3)19(16)21)10-14-6-8-17(20)9-7-14/h6-9,11-13H,4-5,10,20-21H2,1-3H3
InChIKey
IAZGYMXXLFYKOE-UHFFFAOYSA-N
Compound name
4-[(4-aminophenyl)methyl]-2-propan-2-yl-6-propylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

282.2096 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 283.21688 172.0
[M+Na]+ 305.19882 178.3
[M-H]- 281.20232 177.9
[M+NH4]+ 300.24342 187.4
[M+K]+ 321.17276 173.1
[M+H-H2O]+ 265.20686 164.1
[M+HCOO]- 327.20780 194.4
[M+CH3COO]- 341.22345 211.2
[M+Na-2H]- 303.18427 171.8
[M]+ 282.20905 170.4
[M]- 282.21015 170.4
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

No patent data available for this compound.