CID 13258812

4-[4-(tert-butyl)phenyl]piperidine hydrochloride

Structural Information

Molecular Formula
C15H23N
SMILES
CC(C)(C)C1=CC=C(C=C1)C2CCNCC2
InChI
InChI=1S/C15H23N/c1-15(2,3)14-6-4-12(5-7-14)13-8-10-16-11-9-13/h4-7,13,16H,8-11H2,1-3H3
InChIKey
WVOOEDDRRXWYSR-UHFFFAOYSA-N
Compound name
4-(4-tert-butylphenyl)piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

81
Patents

217.18304 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 218.19032 153.9
[M+Na]+ 240.17226 158.1
[M-H]- 216.17576 156.8
[M+NH4]+ 235.21686 170.3
[M+K]+ 256.14620 154.0
[M+H-H2O]+ 200.18030 146.7
[M+HCOO]- 262.18124 169.3
[M+CH3COO]- 276.19689 186.9
[M+Na-2H]- 238.15771 158.0
[M]+ 217.18249 147.5
[M]- 217.18359 147.5
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