CID 10634204

2-amino-3-(morpholin-4-yl)propanoic acid dihydrochloride

Structural Information

Molecular Formula
C7H14N2O3
SMILES
C1COCCN1CC(C(=O)O)N
InChI
InChI=1S/C7H14N2O3/c8-6(7(10)11)5-9-1-3-12-4-2-9/h6H,1-5,8H2,(H,10,11)
InChIKey
XQBWWSOQRZVLPX-UHFFFAOYSA-N
Compound name
2-amino-3-morpholin-4-ylpropanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

38
Patents

174.10045 Da
Monoisotopic Mass

-3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 175.107726 138.8
[M+Na]+ 197.089668 142.4
[M-H]- 173.093174 138.9
[M+NH4]+ 192.134273 154.5
[M+K]+ 213.063608 143.0
[M+H-H2O]+ 157.097710 132.0
[M+HCOO]- 219.098651 155.2
[M+CH3COO]- 233.114301 177.8
[M+Na-2H]- 195.075116 142.2
[M]+ 174.09990142 133.5
[M]- 174.10099858 133.5
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