CID 9570727

Benzamide, n-(2-butylideneaminooxyethyl)-2-ethoxy-3-methoxy-, oxalate

Structural Information

Molecular Formula
C16H24N2O4
SMILES
CC/C(=N/OCCNC(=O)C1=C(C(=CC=C1)OC)OCC)/C
InChI
InChI=1S/C16H24N2O4/c1-5-12(3)18-22-11-10-17-16(19)13-8-7-9-14(20-4)15(13)21-6-2/h7-9H,5-6,10-11H2,1-4H3,(H,17,19)/b18-12+
InChIKey
HSYYJICEMOLZTB-LDADJPATSA-N
Compound name
N-[2-[(E)-butan-2-ylideneamino]oxyethyl]-2-ethoxy-3-methoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

308.1736 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 309.180876 173.8
[M+Na]+ 331.162818 178.6
[M-H]- 307.166324 178.3
[M+NH4]+ 326.207423 188.8
[M+K]+ 347.136758 177.9
[M+H-H2O]+ 291.170860 165.6
[M+HCOO]- 353.171801 198.9
[M+CH3COO]- 367.187451 214.1
[M+Na-2H]- 329.148266 175.6
[M]+ 308.17305142 180.3
[M]- 308.17414858 180.3
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

No patent data available for this compound.