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]+ 149.055676 127.3
[M+Na]+ 171.037618 133.6
[M-H]- 147.041124 127.4
[M+NH4]+ 166.082223 147.5
[M+K]+ 187.011558 135.1
[M+H-H2O]+ 131.045660 121.7
[M+HCOO]- 193.046601 152.5
[M+CH3COO]- 207.062251 177.0
[M+Na-2H]- 169.023066 132.2
[M]+ 148.04785142 128.0
[M]- 148.04894858 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.