CID 69409573

1-(2-aminoethyl)cyclopentane-1-carboxylic acid hydrochloride

Structural Information

Molecular Formula
C8H15NO2
SMILES
C1CCC(C1)(CCN)C(=O)O
InChI
InChI=1S/C8H15NO2/c9-6-5-8(7(10)11)3-1-2-4-8/h1-6,9H2,(H,10,11)
InChIKey
MANGVQVYYPCEMF-UHFFFAOYSA-N
Compound name
1-(2-aminoethyl)cyclopentane-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

157.11028 Da
Monoisotopic Mass

-1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.11756 135.6
[M+Na]+ 180.09950 140.8
[M-H]- 156.10300 136.8
[M+NH4]+ 175.14410 158.6
[M+K]+ 196.07344 139.4
[M+H-H2O]+ 140.10754 131.1
[M+HCOO]- 202.10848 156.7
[M+CH3COO]- 216.12413 174.2
[M+Na-2H]- 178.08495 138.8
[M]+ 157.10973 131.0
[M]- 157.11083 131.0
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