CID 542750

2,2-diethoxy-n,n-dimethylacetamide

Structural Information

Molecular Formula

C₈H₁₇NO₃

SMILES

CCOC(C(=O)N(C)C)OCC

InChI

InChI=1S/C8H17NO3/c1-5-11-8(12-6-2)7(10)9(3)4/h8H,5-6H2,1-4H3

InChIKey

ZFCXPRXCTKPYEO-UHFFFAOYSA-N

Compound name

2,2-diethoxy-N,N-dimethylacetamide

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 61
Patents: 175.12085 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]+	176.128126	140.2
[M+Na]+	198.110068	145.8
[M-H]-	174.113574	141.8
[M+NH4]+	193.154673	160.9
[M+K]+	214.084008	148.2
[M+H-H2O]+	158.118110	134.6
[M+HCOO]-	220.119051	163.9
[M+CH3COO]-	234.134701	187.7
[M+Na-2H]-	196.095516	143.2
[M]+	175.12030142	145.0
[M]-	175.12139858	145.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe