CID 63156532

4-(4-chlorophenyl)-4-ethylpiperidine hydrochloride

Structural Information

Molecular Formula
C13H18ClN
SMILES
CCC1(CCNCC1)C2=CC=C(C=C2)Cl
InChI
InChI=1S/C13H18ClN/c1-2-13(7-9-15-10-8-13)11-3-5-12(14)6-4-11/h3-6,15H,2,7-10H2,1H3
InChIKey
WOZIGWHGTHNEJQ-UHFFFAOYSA-N
Compound name
4-(4-chlorophenyl)-4-ethylpiperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

223.11278 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 224.120056 150.8
[M+Na]+ 246.101998 157.0
[M-H]- 222.105504 153.8
[M+NH4]+ 241.146603 169.6
[M+K]+ 262.075938 151.4
[M+H-H2O]+ 206.110040 144.2
[M+HCOO]- 268.110981 163.8
[M+CH3COO]- 282.126631 161.8
[M+Na-2H]- 244.087446 155.7
[M]+ 223.11223142 146.5
[M]- 223.11332858 146.5
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

patents stripe