CID 200459

2104-80-5

Structural Information

Molecular Formula
C25H29NO
SMILES
CC(CN(C)CCC1=CC=CC=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)O
InChI
InChI=1S/C25H29NO/c1-21(20-26(2)19-18-22-12-6-3-7-13-22)25(27,23-14-8-4-9-15-23)24-16-10-5-11-17-24/h3-17,21,27H,18-20H2,1-2H3
InChIKey
BYFJJBSEECDXNB-UHFFFAOYSA-N
Compound name
2-methyl-3-[methyl(2-phenylethyl)amino]-1,1-diphenylpropan-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 190.5
[M+Na]+ 382.214118 192.3
[M-H]- 358.217624 198.5
[M+NH4]+ 377.258723 201.5
[M+K]+ 398.188058 187.3
[M+H-H2O]+ 342.222160 180.5
[M+HCOO]- 404.223101 209.9
[M+CH3COO]- 418.238751 219.7
[M+Na-2H]- 380.199566 193.9
[M]+ 359.22435142 189.5
[M]- 359.22544858 189.5
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.