CID 11971533

Alpha-(((1-methylethyl)amino)methyl)-4-phenyl-1-piperazineethanol hydrochloride

Structural Information

Molecular Formula
C16H27N3O
SMILES
CC(C)NCC(CN1CCN(CC1)C2=CC=CC=C2)O
InChI
InChI=1S/C16H27N3O/c1-14(2)17-12-16(20)13-18-8-10-19(11-9-18)15-6-4-3-5-7-15/h3-7,14,16-17,20H,8-13H2,1-2H3
InChIKey
VNWDQLKGKPAKQZ-UHFFFAOYSA-N
Compound name
1-(4-phenylpiperazin-1-yl)-3-(propan-2-ylamino)propan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

277.21542 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.22270 169.7
[M+Na]+ 300.20464 179.3
[M+NH4]+ 295.24924 176.4
[M+K]+ 316.17858 173.3
[M-H]- 276.20814 172.3
[M+Na-2H]- 298.19009 174.9
[M]+ 277.21487 171.5
[M]- 277.21597 171.5
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.