CID 111692

68892-06-8

Structural Information

Molecular Formula
C5H9NO3
SMILES
CN(CC(=O)OC)C=O
InChI
InChI=1S/C5H9NO3/c1-6(4-7)3-5(8)9-2/h4H,3H2,1-2H3
InChIKey
YPHUWLXQOBCRNQ-UHFFFAOYSA-N
Compound name
methyl 2-[formyl(methyl)amino]acetate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

63
Patents

131.05824 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 132.065516 124.1
[M+Na]+ 154.047458 131.5
[M-H]- 130.050964 126.2
[M+NH4]+ 149.092063 146.5
[M+K]+ 170.021398 133.5
[M+H-H2O]+ 114.055500 119.1
[M+HCOO]- 176.056441 150.0
[M+CH3COO]- 190.072091 176.8
[M+Na-2H]- 152.032906 130.1
[M]+ 131.05769142 127.8
[M]- 131.05878858 127.8
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