CID 3056443

1-(1-(p-tolyl)propyl)piperidine hydrochloride

Structural Information

Molecular Formula
C15H23N
SMILES
CCC(C1=CC=C(C=C1)C)N2CCCCC2
InChI
InChI=1S/C15H23N/c1-3-15(16-11-5-4-6-12-16)14-9-7-13(2)8-10-14/h7-10,15H,3-6,11-12H2,1-2H3
InChIKey
ZQLPHSZLROJJTK-UHFFFAOYSA-N
Compound name
1-[1-(4-methylphenyl)propyl]piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

217.18304 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 218.190316 153.4
[M+Na]+ 240.172258 157.1
[M-H]- 216.175764 157.3
[M+NH4]+ 235.216863 170.2
[M+K]+ 256.146198 154.0
[M+H-H2O]+ 200.180300 145.2
[M+HCOO]- 262.181241 170.8
[M+CH3COO]- 276.196891 190.7
[M+Na-2H]- 238.157706 156.0
[M]+ 217.18249142 148.7
[M]- 217.18358858 148.7
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

patents stripe