CID 3051740

3-phenyl-3-o-hydroxyphenyl-n-(phenylisopropyl)propylamine hydrochloride

Structural Information

Molecular Formula
C24H27NO
SMILES
CC(CC1=CC=CC=C1)NCCC(C2=CC=CC=C2)C3=CC=CC=C3O
InChI
InChI=1S/C24H27NO/c1-19(18-20-10-4-2-5-11-20)25-17-16-22(21-12-6-3-7-13-21)23-14-8-9-15-24(23)26/h2-15,19,22,25-26H,16-18H2,1H3
InChIKey
USLXAAUGPAAHPF-UHFFFAOYSA-N
Compound name
2-[1-phenyl-3-(1-phenylpropan-2-ylamino)propyl]phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

345.20926 Da
Monoisotopic Mass

5.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 346.216536 186.4
[M+Na]+ 368.198478 188.8
[M-H]- 344.201984 193.3
[M+NH4]+ 363.243083 197.5
[M+K]+ 384.172418 182.6
[M+H-H2O]+ 328.206520 176.6
[M+HCOO]- 390.207461 206.3
[M+CH3COO]- 404.223111 215.0
[M+Na-2H]- 366.183926 188.4
[M]+ 345.20871142 184.1
[M]- 345.20980858 184.1
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.