CID 58863202

1,2-dimethylpiperidine-4-carboxylic acid hydrochloride

Structural Information

Molecular Formula
C8H15NO2
SMILES
CC1CC(CCN1C)C(=O)O
InChI
InChI=1S/C8H15NO2/c1-6-5-7(8(10)11)3-4-9(6)2/h6-7H,3-5H2,1-2H3,(H,10,11)
InChIKey
KNRGPNUMYGQKOA-UHFFFAOYSA-N
Compound name
1,2-dimethylpiperidine-4-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

157.11028 Da
Monoisotopic Mass

-1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.117556 134.4
[M+Na]+ 180.099498 140.6
[M-H]- 156.103004 135.0
[M+NH4]+ 175.144103 153.5
[M+K]+ 196.073438 139.6
[M+H-H2O]+ 140.107540 128.8
[M+HCOO]- 202.108481 151.8
[M+CH3COO]- 216.124131 175.7
[M+Na-2H]- 178.084946 137.1
[M]+ 157.10973142 130.6
[M]- 157.11082858 130.6
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