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
1
Annotation Hits

0
References

50
Patents

175.12085 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 176.12813 140.2
[M+Na]+ 198.11007 145.8
[M-H]- 174.11357 141.8
[M+NH4]+ 193.15467 160.9
[M+K]+ 214.08401 148.2
[M+H-H2O]+ 158.11811 134.6
[M+HCOO]- 220.11905 163.9
[M+CH3COO]- 234.13470 187.7
[M+Na-2H]- 196.09552 143.2
[M]+ 175.12030 145.0
[M]- 175.12140 145.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe