CID 203504

14593-39-6

Structural Information

Molecular Formula
C22H23NO2
SMILES
COC1=CC=C(C=C1)C(CC(C2=CC=CC=C2)(C3=CC=CC=C3)O)N
InChI
InChI=1S/C22H23NO2/c1-25-20-14-12-17(13-15-20)21(23)16-22(24,18-8-4-2-5-9-18)19-10-6-3-7-11-19/h2-15,21,24H,16,23H2,1H3
InChIKey
APJHRUHEYLXFIE-UHFFFAOYSA-N
Compound name
3-amino-3-(4-methoxyphenyl)-1,1-diphenylpropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

333.17288 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 334.18016 180.9
[M+Na]+ 356.16210 184.8
[M-H]- 332.16560 188.0
[M+NH4]+ 351.20670 192.4
[M+K]+ 372.13604 179.5
[M+H-H2O]+ 316.17014 171.8
[M+HCOO]- 378.17108 200.5
[M+CH3COO]- 392.18673 210.3
[M+Na-2H]- 354.14755 185.0
[M]+ 333.17233 178.6
[M]- 333.17343 178.6
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

patents stripe