CID 165589521

4-methyl-1-azabicyclo[2.2.1]heptane-3-carboxylic acid hydrochloride

Structural Information

Molecular Formula
C8H13NO2
SMILES
CC12CCN(C1)CC2C(=O)O
InChI
InChI=1S/C8H13NO2/c1-8-2-3-9(5-8)4-6(8)7(10)11/h6H,2-5H2,1H3,(H,10,11)
InChIKey
YGCRKDAADIJFBA-UHFFFAOYSA-N
Compound name
4-methyl-1-azabicyclo[2.2.1]heptane-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

155.09464 Da
Monoisotopic Mass

-1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.10192 134.8
[M+Na]+ 178.08386 142.5
[M-H]- 154.08736 135.1
[M+NH4]+ 173.12846 160.8
[M+K]+ 194.05780 141.0
[M+H-H2O]+ 138.09190 130.8
[M+HCOO]- 200.09284 153.2
[M+CH3COO]- 214.10849 173.2
[M+Na-2H]- 176.06931 138.4
[M]+ 155.09409 133.1
[M]- 155.09519 133.1
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.