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]+ 332.20088 181.1
[M+Na]+ 354.18282 183.8
[M-H]- 330.18632 188.1
[M+NH4]+ 349.22742 192.7
[M+K]+ 370.15676 177.8
[M+H-H2O]+ 314.19086 171.8
[M+HCOO]- 376.19180 200.8
[M+CH3COO]- 390.20745 210.6
[M+Na-2H]- 352.16827 186.4
[M]+ 331.19305 178.3
[M]- 331.19415 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.