CID 9857387

186769-18-6

Structural Information

Molecular Formula
C20H28N2
SMILES
CC1=CC(=C(C(=C1)C)C(C(C2=C(C=C(C=C2C)C)C)N)N)C
InChI
InChI=1S/C20H28N2/c1-11-7-13(3)17(14(4)8-11)19(21)20(22)18-15(5)9-12(2)10-16(18)6/h7-10,19-20H,21-22H2,1-6H3
InChIKey
ILMRHFMYIXTNMC-UHFFFAOYSA-N
Compound name
1,2-bis(2,4,6-trimethylphenyl)ethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

83
Patents

296.22525 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 297.23253 177.5
[M+Na]+ 319.21447 190.6
[M+NH4]+ 314.25907 185.6
[M+K]+ 335.18841 183.4
[M-H]- 295.21797 183.5
[M+Na-2H]- 317.19992 183.8
[M]+ 296.22470 181.2
[M]- 296.22580 181.2
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