CID 214250

1-(4-methylphenyl)-3-(piperidin-1-yl)propan-1-ol

Structural Information

Molecular Formula
C15H23NO
SMILES
CC1=CC=C(C=C1)C(CCN2CCCCC2)O
InChI
InChI=1S/C15H23NO/c1-13-5-7-14(8-6-13)15(17)9-12-16-10-3-2-4-11-16/h5-8,15,17H,2-4,9-12H2,1H3
InChIKey
GXRAJZWYNQFLHV-UHFFFAOYSA-N
Compound name
1-(4-methylphenyl)-3-piperidin-1-ylpropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

233.17796 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 234.185236 157.3
[M+Na]+ 256.167178 160.5
[M-H]- 232.170684 159.8
[M+NH4]+ 251.211783 172.6
[M+K]+ 272.141118 157.0
[M+H-H2O]+ 216.175220 149.2
[M+HCOO]- 278.176161 173.4
[M+CH3COO]- 292.191811 190.1
[M+Na-2H]- 254.152626 159.4
[M]+ 233.17741142 152.2
[M]- 233.17850858 152.2
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.