CID 3060414

78110-00-6

Structural Information

Molecular Formula
C20H25NO
SMILES
CC(CNC1CCC1)C(C2=CC=CC=C2)(C3=CC=CC=C3)O
InChI
InChI=1S/C20H25NO/c1-16(15-21-19-13-8-14-19)20(22,17-9-4-2-5-10-17)18-11-6-3-7-12-18/h2-7,9-12,16,19,21-22H,8,13-15H2,1H3
InChIKey
PJTXWIMJWKSNRZ-UHFFFAOYSA-N
Compound name
3-(cyclobutylamino)-2-methyl-1,1-diphenylpropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

295.1936 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.20088 170.5
[M+Na]+ 318.18282 171.8
[M-H]- 294.18632 177.1
[M+NH4]+ 313.22742 177.5
[M+K]+ 334.15676 170.5
[M+H-H2O]+ 278.19086 156.5
[M+HCOO]- 340.19180 188.1
[M+CH3COO]- 354.20745 206.5
[M+Na-2H]- 316.16827 174.3
[M]+ 295.19305 175.1
[M]- 295.19415 175.1
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.