CID 21430458

38188-92-0

Structural Information

Molecular Formula

C₅H₁₁NO₂

SMILES

CNC(=O)CCOC

InChI

InChI=1S/C5H11NO2/c1-6-5(7)3-4-8-2/h3-4H2,1-2H3,(H,6,7)

InChIKey

SIXSDXBPHBHLPS-UHFFFAOYSA-N

Compound name

3-methoxy-N-methylpropanamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 153
Patents: 117.07898 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]+	118.086256	123.5
[M+Na]+	140.068198	130.4
[M-H]-	116.071704	124.0
[M+NH4]+	135.112803	145.9
[M+K]+	156.042138	131.2
[M+H-H2O]+	100.076240	118.7
[M+HCOO]-	162.077181	148.3
[M+CH3COO]-	176.092831	172.1
[M+Na-2H]-	138.053646	130.0
[M]+	117.07843142	125.0
[M]-	117.07952858	125.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe