CID 16768971

3-(cyclopentylamino)propanoic acid hydrochloride

Structural Information

Molecular Formula
C8H15NO2
SMILES
C1CCC(C1)NCCC(=O)O
InChI
InChI=1S/C8H15NO2/c10-8(11)5-6-9-7-3-1-2-4-7/h7,9H,1-6H2,(H,10,11)
InChIKey
MWKAFAOTXUBGKV-UHFFFAOYSA-N
Compound name
3-(cyclopentylamino)propanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

27
Patents

157.11028 Da
Monoisotopic Mass

-1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.117556 135.8
[M+Na]+ 180.099498 140.0
[M-H]- 156.103004 137.2
[M+NH4]+ 175.144103 157.0
[M+K]+ 196.073438 138.9
[M+H-H2O]+ 140.107540 130.2
[M+HCOO]- 202.108481 157.5
[M+CH3COO]- 216.124131 175.3
[M+Na-2H]- 178.084946 138.8
[M]+ 157.10973142 131.9
[M]- 157.11082858 131.9
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