CID 64281004

4-[(prop-2-en-1-yloxy)carbonyl]morpholine-2-carboxylic acid

Structural Information

Molecular Formula
C9H13NO5
SMILES
C=CCOC(=O)N1CCOC(C1)C(=O)O
InChI
InChI=1S/C9H13NO5/c1-2-4-15-9(13)10-3-5-14-7(6-10)8(11)12/h2,7H,1,3-6H2,(H,11,12)
InChIKey
JQPCJSJUIPSICG-UHFFFAOYSA-N
Compound name
4-prop-2-enoxycarbonylmorpholine-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

215.07938 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.086656 145.3
[M+Na]+ 238.068598 150.5
[M-H]- 214.072104 146.1
[M+NH4]+ 233.113203 160.2
[M+K]+ 254.042538 150.9
[M+H-H2O]+ 198.076640 138.8
[M+HCOO]- 260.077581 161.6
[M+CH3COO]- 274.093231 182.0
[M+Na-2H]- 236.054046 148.1
[M]+ 215.07883142 144.4
[M]- 215.07992858 144.4
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.