CID 45084522

766539-67-7

Structural Information

Molecular Formula

C₇H₁₃NO₃

SMILES

CN(C(=O)C1CCOC1)OC

InChI

InChI=1S/C7H13NO3/c1-8(10-2)7(9)6-3-4-11-5-6/h6H,3-5H2,1-2H3

InChIKey

DKBCSKRFSZEHFE-UHFFFAOYSA-N

Compound name

N-methoxy-N-methyloxolane-3-carboxamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 186
Patents: 159.08954 Da
Monoisotopic Mass: -0.3
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]+	160.096816	133.9
[M+Na]+	182.078758	139.2
[M-H]-	158.082264	139.0
[M+NH4]+	177.123363	155.2
[M+K]+	198.052698	142.0
[M+H-H2O]+	142.086800	128.2
[M+HCOO]-	204.087741	157.3
[M+CH3COO]-	218.103391	179.8
[M+Na-2H]-	180.064206	138.2
[M]+	159.08899142	134.8
[M]-	159.09008858	134.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe