CID 469933

1-butanol, 2,2'-[(1,2-diphenyl-1,2-ethanediyl)bis(imino)]bis-

Structural Information

Molecular Formula
C22H32N2O2
SMILES
CCC(CO)NC(C1=CC=CC=C1)C(C2=CC=CC=C2)NC(CC)CO
InChI
InChI=1S/C22H32N2O2/c1-3-19(15-25)23-21(17-11-7-5-8-12-17)22(24-20(4-2)16-26)18-13-9-6-10-14-18/h5-14,19-26H,3-4,15-16H2,1-2H3
InChIKey
UHIVZXDZYYUGPJ-UHFFFAOYSA-N
Compound name
2-[[2-(1-hydroxybutan-2-ylamino)-1,2-diphenylethyl]amino]butan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

356.24637 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 357.25365 190.8
[M+Na]+ 379.23559 189.8
[M-H]- 355.23909 192.7
[M+NH4]+ 374.28019 200.4
[M+K]+ 395.20953 185.8
[M+H-H2O]+ 339.24363 181.7
[M+HCOO]- 401.24457 207.8
[M+CH3COO]- 415.26022 218.6
[M+Na-2H]- 377.22104 189.6
[M]+ 356.24582 187.8
[M]- 356.24692 187.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.