CID 120810

850-67-9

Structural Information

Molecular Formula
C21H21NO
SMILES
C1=CC=C(C=C1)C(CC(C2=CC=CC=C2)(C3=CC=CC=C3)O)N
InChI
InChI=1S/C21H21NO/c22-20(17-10-4-1-5-11-17)16-21(23,18-12-6-2-7-13-18)19-14-8-3-9-15-19/h1-15,20,23H,16,22H2
InChIKey
MYKUUOGRLSMSGH-UHFFFAOYSA-N
Compound name
3-amino-1,1,3-triphenylpropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

303.16232 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 304.16960 172.7
[M+Na]+ 326.15154 176.3
[M-H]- 302.15504 179.6
[M+NH4]+ 321.19614 185.2
[M+K]+ 342.12548 170.4
[M+H-H2O]+ 286.15958 163.9
[M+HCOO]- 348.16052 192.4
[M+CH3COO]- 362.17617 204.1
[M+Na-2H]- 324.13699 178.1
[M]+ 303.16177 168.2
[M]- 303.16287 168.2
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.