CID 202141

7550-24-5

Structural Information

Molecular Formula
C19H24N2O
SMILES
CC1=CC=C(C=C1)C(CO)N2CCN(CC2)C3=CC=CC=C3
InChI
InChI=1S/C19H24N2O/c1-16-7-9-17(10-8-16)19(15-22)21-13-11-20(12-14-21)18-5-3-2-4-6-18/h2-10,19,22H,11-15H2,1H3
InChIKey
LSBTUZMZAVUNBV-UHFFFAOYSA-N
Compound name
2-(4-methylphenyl)-2-(4-phenylpiperazin-1-yl)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

296.18887 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 297.19615 174.2
[M+Na]+ 319.17809 188.2
[M+NH4]+ 314.22269 182.3
[M+K]+ 335.15203 179.9
[M-H]- 295.18159 179.6
[M+Na-2H]- 317.16354 183.2
[M]+ 296.18832 177.7
[M]- 296.18942 177.7
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.