CID 11722

Methyl carbamate

Structural Information

Molecular Formula

SMILES

COC(=O)N

InChI

InChI=1S/C2H5NO2/c1-5-2(3)4/h1H3,(H2,3,4)

InChIKey

GTCAXTIRRLKXRU-UHFFFAOYSA-N

Compound name

methyl carbamate

Related CIDs

2D Structure

compound 2d structure

6
Annotation Hits: 136
References: 47683
Patents: 75.03203 Da
Monoisotopic Mass: -0.7
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]+	76.039306	110.3
[M+Na]+	98.021248	119.8
[M+NH4]+	93.065853	118.1
[M+K]+	113.99519	116.2
[M-H]-	74.024754	109.6
[M+Na-2H]-	96.006696	114.2
[M]+	75.031481	111.0
[M]-	75.032579	111.0

Literature stripe

literature stripe

Patent stripe

patents stripe