CID 165606098

2-(2-amino-3-hydroxypropyl)cyclopropane-1-carboxylic acid hydrochloride

Structural Information

Molecular Formula
C7H13NO3
SMILES
C1C(C1C(=O)O)CC(CO)N
InChI
InChI=1S/C7H13NO3/c8-5(3-9)1-4-2-6(4)7(10)11/h4-6,9H,1-3,8H2,(H,10,11)
InChIKey
GLNHNBMSUXKDQT-UHFFFAOYSA-N
Compound name
2-(2-amino-3-hydroxypropyl)cyclopropane-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

159.08954 Da
Monoisotopic Mass

-3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.09682 130.6
[M+Na]+ 182.07876 138.5
[M-H]- 158.08226 132.4
[M+NH4]+ 177.12336 144.9
[M+K]+ 198.05270 135.5
[M+H-H2O]+ 142.08680 125.4
[M+HCOO]- 204.08774 150.9
[M+CH3COO]- 218.10339 179.3
[M+Na-2H]- 180.06421 133.2
[M]+ 159.08899 131.0
[M]- 159.09009 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

No patent data available for this compound.