CID 1530103

4-(cyclopentylamino)-4-oxobutanoic acid

Structural Information

Molecular Formula
C9H15NO3
SMILES
C1CCC(C1)NC(=O)CCC(=O)O
InChI
InChI=1S/C9H15NO3/c11-8(5-6-9(12)13)10-7-3-1-2-4-7/h7H,1-6H2,(H,10,11)(H,12,13)
InChIKey
NUNSFUWCFOMRJP-UHFFFAOYSA-N
Compound name
4-(cyclopentylamino)-4-oxobutanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

185.1052 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.11248 143.1
[M+Na]+ 208.09442 149.2
[M+NH4]+ 203.13902 149.4
[M+K]+ 224.06836 147.5
[M-H]- 184.09792 142.3
[M+Na-2H]- 206.07987 144.7
[M]+ 185.10465 143.1
[M]- 185.10575 143.1
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

patents stripe