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

2
Patents

237.10011 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 238.10739 151.0
[M+Na]+ 260.08933 158.2
[M-H]- 236.09283 154.8
[M+NH4]+ 255.13393 168.6
[M+K]+ 276.06327 157.1
[M+H-H2O]+ 220.09737 144.3
[M+HCOO]- 282.09831 175.9
[M+CH3COO]- 296.11396 194.2
[M+Na-2H]- 258.07478 155.4
[M]+ 237.09956 155.7
[M]- 237.10066 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