CID 66764604

1-(1-aminoethyl)cyclopropane-1-carboxylic acid hydrochloride

Structural Information

Molecular Formula
C6H11NO2
SMILES
CC(C1(CC1)C(=O)O)N
InChI
InChI=1S/C6H11NO2/c1-4(7)6(2-3-6)5(8)9/h4H,2-3,7H2,1H3,(H,8,9)
InChIKey
ZPESMVWSTKZNNQ-UHFFFAOYSA-N
Compound name
1-(1-aminoethyl)cyclopropane-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

129.07898 Da
Monoisotopic Mass

-2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.086256 125.3
[M+Na]+ 152.068198 133.7
[M-H]- 128.071704 128.6
[M+NH4]+ 147.112803 143.1
[M+K]+ 168.042138 132.6
[M+H-H2O]+ 112.076240 121.3
[M+HCOO]- 174.077181 146.7
[M+CH3COO]- 188.092831 175.1
[M+Na-2H]- 150.053646 130.5
[M]+ 129.07843142 125.7
[M]- 129.07952858 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