CID 199385

Brn 2819658

Structural Information

Molecular Formula
C25H29NO
SMILES
CN(CCCC(C1=CC=CC=C1)(C2=CC=CC=C2)O)CCC3=CC=CC=C3
InChI
InChI=1S/C25H29NO/c1-26(21-18-22-12-5-2-6-13-22)20-11-19-25(27,23-14-7-3-8-15-23)24-16-9-4-10-17-24/h2-10,12-17,27H,11,18-21H2,1H3
InChIKey
HADVEWDCCJDKGD-UHFFFAOYSA-N
Compound name
4-[methyl(2-phenylethyl)amino]-1,1-diphenylbutan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

359.2249 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 360.232176 190.7
[M+Na]+ 382.214118 192.8
[M-H]- 358.217624 198.5
[M+NH4]+ 377.258723 201.7
[M+K]+ 398.188058 187.2
[M+H-H2O]+ 342.222160 180.4
[M+HCOO]- 404.223101 211.0
[M+CH3COO]- 418.238751 218.8
[M+Na-2H]- 380.199566 195.1
[M]+ 359.22435142 190.2
[M]- 359.22544858 190.2
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

No patent data available for this compound.