CID 335844

Amino(1-cyclopenten-1-yl)acetic acid

Structural Information

Molecular Formula
C7H11NO2
SMILES
C1CC=C(C1)C(C(=O)O)N
InChI
InChI=1S/C7H11NO2/c8-6(7(9)10)5-3-1-2-4-5/h3,6H,1-2,4,8H2,(H,9,10)
InChIKey
IBKAAQVFRPAZHK-UHFFFAOYSA-N
Compound name
2-amino-2-(cyclopenten-1-yl)acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

50
Patents

141.07898 Da
Monoisotopic Mass

-2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.086256 130.4
[M+Na]+ 164.068198 135.9
[M-H]- 140.071704 132.0
[M+NH4]+ 159.112803 152.0
[M+K]+ 180.042138 134.9
[M+H-H2O]+ 124.076240 125.1
[M+HCOO]- 186.077181 152.3
[M+CH3COO]- 200.092831 172.1
[M+Na-2H]- 162.053646 132.6
[M]+ 141.07843142 125.9
[M]- 141.07952858 125.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe