CID 203697

4-phenyl-1-propylpiperidine hydrochloride

Structural Information

Molecular Formula
C14H21N
SMILES
CCCN1CCC(CC1)C2=CC=CC=C2
InChI
InChI=1S/C14H21N/c1-2-10-15-11-8-14(9-12-15)13-6-4-3-5-7-13/h3-7,14H,2,8-12H2,1H3
InChIKey
DIXPHRIXQYGPLM-UHFFFAOYSA-N
Compound name
4-phenyl-1-propylpiperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

100
Patents

203.1674 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 204.17468 148.7
[M+Na]+ 226.15662 153.1
[M-H]- 202.16012 152.7
[M+NH4]+ 221.20122 166.1
[M+K]+ 242.13056 149.8
[M+H-H2O]+ 186.16466 140.6
[M+HCOO]- 248.16560 167.4
[M+CH3COO]- 262.18125 186.9
[M+Na-2H]- 224.14207 153.0
[M]+ 203.16685 144.3
[M]- 203.16795 144.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe