CID 3060408

78109-96-3

Structural Information

Molecular Formula
C23H25NO
SMILES
CC(CNCC1=CC=CC=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)O
InChI
InChI=1S/C23H25NO/c1-19(17-24-18-20-11-5-2-6-12-20)23(25,21-13-7-3-8-14-21)22-15-9-4-10-16-22/h2-16,19,24-25H,17-18H2,1H3
InChIKey
FMRUBXQQSIIGPL-UHFFFAOYSA-N
Compound name
3-(benzylamino)-2-methyl-1,1-diphenylpropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

331.1936 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 332.200876 181.1
[M+Na]+ 354.182818 183.8
[M-H]- 330.186324 188.1
[M+NH4]+ 349.227423 192.7
[M+K]+ 370.156758 177.8
[M+H-H2O]+ 314.190860 171.8
[M+HCOO]- 376.191801 200.8
[M+CH3COO]- 390.207451 210.6
[M+Na-2H]- 352.168266 186.4
[M]+ 331.19305142 178.3
[M]- 331.19414858 178.3
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.