CID 104466410

1566524-85-3

Structural Information

Molecular Formula
C4H8N2O4
SMILES
COC(=O)NOCC(=O)N
InChI
InChI=1S/C4H8N2O4/c1-9-4(8)6-10-2-3(5)7/h2H2,1H3,(H2,5,7)(H,6,8)
InChIKey
REFLULHGHPMIFL-UHFFFAOYSA-N
Compound name
methyl N-(2-amino-2-oxoethoxy)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

148.0484 Da
Monoisotopic Mass

-1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 149.05568 127.3
[M+Na]+ 171.03762 133.6
[M-H]- 147.04112 127.4
[M+NH4]+ 166.08222 147.5
[M+K]+ 187.01156 135.1
[M+H-H2O]+ 131.04566 121.7
[M+HCOO]- 193.04660 152.5
[M+CH3COO]- 207.06225 177.0
[M+Na-2H]- 169.02307 132.2
[M]+ 148.04785 128.0
[M]- 148.04895 128.0
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.