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]+ 296.200876 170.5
[M+Na]+ 318.182818 171.8
[M-H]- 294.186324 177.1
[M+NH4]+ 313.227423 177.5
[M+K]+ 334.156758 170.5
[M+H-H2O]+ 278.190860 156.5
[M+HCOO]- 340.191801 188.1
[M+CH3COO]- 354.207451 206.5
[M+Na-2H]- 316.168266 174.3
[M]+ 295.19305142 175.1
[M]- 295.19414858 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.