CID 136576237

2,5-dimethylpiperidine-4-carboxylic acid hydrochloride

Structural Information

Molecular Formula
C8H15NO2
SMILES
CC1CC(C(CN1)C)C(=O)O
InChI
InChI=1S/C8H15NO2/c1-5-4-9-6(2)3-7(5)8(10)11/h5-7,9H,3-4H2,1-2H3,(H,10,11)
InChIKey
XASWLGWARDHUEE-UHFFFAOYSA-N
Compound name
2,5-dimethylpiperidine-4-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

157.11028 Da
Monoisotopic Mass

-1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.11756 135.4
[M+Na]+ 180.09950 141.2
[M-H]- 156.10300 134.6
[M+NH4]+ 175.14410 153.8
[M+K]+ 196.07344 139.3
[M+H-H2O]+ 140.10754 130.0
[M+HCOO]- 202.10848 151.3
[M+CH3COO]- 216.12413 173.2
[M+Na-2H]- 178.08495 137.5
[M]+ 157.10973 129.7
[M]- 157.11083 129.7
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

No patent data available for this compound.