CID 3047203

1-(n-piperidyl)-6-methyl-3-phenyl-heptanol hydrochloride

Structural Information

Molecular Formula
C19H31NO
SMILES
CC(C)CCC(CCN1CCCCC1)(C2=CC=CC=C2)O
InChI
InChI=1S/C19H31NO/c1-17(2)11-12-19(21,18-9-5-3-6-10-18)13-16-20-14-7-4-8-15-20/h3,5-6,9-10,17,21H,4,7-8,11-16H2,1-2H3
InChIKey
FHTWNTKDXPHJFT-UHFFFAOYSA-N
Compound name
6-methyl-3-phenyl-1-piperidin-1-ylheptan-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

289.24057 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 290.24785 175.3
[M+Na]+ 312.22979 185.6
[M+NH4]+ 307.27439 182.9
[M+K]+ 328.20373 178.4
[M-H]- 288.23329 178.0
[M+Na-2H]- 310.21524 181.1
[M]+ 289.24002 177.5
[M]- 289.24112 177.5
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.