CID 15037334

Methyl (iminomethoxymethyl)-carbamate

Structural Information

Molecular Formula

C₄H₈N₂O₃

SMILES

COC(=O)NCOC=N

InChI

InChI=1S/C4H8N2O3/c1-8-4(7)6-3-9-2-5/h2,5H,3H2,1H3,(H,6,7)

InChIKey

AXDCNQMJSHRGHN-UHFFFAOYSA-N

Compound name

(methoxycarbonylamino)methyl methanimidate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 25
Patents: 132.0535 Da
Monoisotopic Mass: 0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	133.060776	124.0
[M+Na]+	155.042718	130.6
[M-H]-	131.046224	124.5
[M+NH4]+	150.087323	145.2
[M+K]+	171.016658	131.4
[M+H-H2O]+	115.050760	118.6
[M+HCOO]-	177.051701	150.5
[M+CH3COO]-	191.067351	174.5
[M+Na-2H]-	153.028166	131.2
[M]+	132.05295142	124.9
[M]-	132.05404858	124.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe