CID 3059637

76907-73-8

Structural Information

Molecular Formula
C20H34N2O
SMILES
CCCN(CCC)CC(CN1CCC(CC1)C2=CC=CC=C2)O
InChI
InChI=1S/C20H34N2O/c1-3-12-21(13-4-2)16-20(23)17-22-14-10-19(11-15-22)18-8-6-5-7-9-18/h5-9,19-20,23H,3-4,10-17H2,1-2H3
InChIKey
OMGAWFTVMJHMJX-UHFFFAOYSA-N
Compound name
1-(dipropylamino)-3-(4-phenylpiperidin-1-yl)propan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

318.26712 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 319.27440 183.1
[M+Na]+ 341.25634 183.3
[M-H]- 317.25984 185.9
[M+NH4]+ 336.30094 195.1
[M+K]+ 357.23028 179.9
[M+H-H2O]+ 301.26438 173.4
[M+HCOO]- 363.26532 198.9
[M+CH3COO]- 377.28097 213.3
[M+Na-2H]- 339.24179 182.2
[M]+ 318.26657 180.2
[M]- 318.26767 180.2
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.