CID 14474455

2-(2-formylphenoxy)-n,n-dimethylacetamide

Structural Information

Molecular Formula
C11H13NO3
SMILES
CN(C)C(=O)COC1=CC=CC=C1C=O
InChI
InChI=1S/C11H13NO3/c1-12(2)11(14)8-15-10-6-4-3-5-9(10)7-13/h3-7H,8H2,1-2H3
InChIKey
DGEPAQUIZIHKQL-UHFFFAOYSA-N
Compound name
2-(2-formylphenoxy)-N,N-dimethylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

207.08954 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.09682 143.8
[M+Na]+ 230.07876 150.9
[M-H]- 206.08226 149.0
[M+NH4]+ 225.12336 163.1
[M+K]+ 246.05270 150.7
[M+H-H2O]+ 190.08680 137.2
[M+HCOO]- 252.08774 169.4
[M+CH3COO]- 266.10339 191.3
[M+Na-2H]- 228.06421 148.7
[M]+ 207.08899 147.6
[M]- 207.09009 147.6
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