CID 2430743

N-ethyl-2-(4-formyl-2-methoxyphenoxy)acetamide

Structural Information

Molecular Formula
C12H15NO4
SMILES
CCNC(=O)COC1=C(C=C(C=C1)C=O)OC
InChI
InChI=1S/C12H15NO4/c1-3-13-12(15)8-17-10-5-4-9(7-14)6-11(10)16-2/h4-7H,3,8H2,1-2H3,(H,13,15)
InChIKey
DEKHHYUNIVIVFV-UHFFFAOYSA-N
Compound name
N-ethyl-2-(4-formyl-2-methoxyphenoxy)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

3
Patents

237.10011 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 238.107386 151.0
[M+Na]+ 260.089328 158.2
[M-H]- 236.092834 154.8
[M+NH4]+ 255.133933 168.6
[M+K]+ 276.063268 157.1
[M+H-H2O]+ 220.097370 144.3
[M+HCOO]- 282.098311 175.9
[M+CH3COO]- 296.113961 194.2
[M+Na-2H]- 258.074776 155.4
[M]+ 237.09956142 155.7
[M]- 237.10065858 155.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe