CID 67230266

3-amino-1-methylcyclopentane-1-carboxylic acid hydrochloride

Structural Information

Molecular Formula
C7H13NO2
SMILES
CC1(CCC(C1)N)C(=O)O
InChI
InChI=1S/C7H13NO2/c1-7(6(9)10)3-2-5(8)4-7/h5H,2-4,8H2,1H3,(H,9,10)
InChIKey
SPEYRPPFKLWNOK-UHFFFAOYSA-N
Compound name
3-amino-1-methylcyclopentane-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

143.09464 Da
Monoisotopic Mass

-2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.10192 130.2
[M+Na]+ 166.08386 136.8
[M-H]- 142.08736 132.0
[M+NH4]+ 161.12846 154.1
[M+K]+ 182.05780 135.6
[M+H-H2O]+ 126.09190 126.3
[M+HCOO]- 188.09284 151.6
[M+CH3COO]- 202.10849 172.4
[M+Na-2H]- 164.06931 133.3
[M]+ 143.09409 125.7
[M]- 143.09519 125.7
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

patents stripe