CID 9570728

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

Structural Information

Molecular Formula
C17H26N2O4
SMILES
CCCOC1=C(C=CC=C1OC)C(=O)NCCO/N=C(\C)/CC
InChI
InChI=1S/C17H26N2O4/c1-5-11-22-16-14(8-7-9-15(16)21-4)17(20)18-10-12-23-19-13(3)6-2/h7-9H,5-6,10-12H2,1-4H3,(H,18,20)/b19-13+
InChIKey
CAAVLCVKRVDPSF-CPNJWEJPSA-N
Compound name
N-[2-[(E)-butan-2-ylideneamino]oxyethyl]-3-methoxy-2-propoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

322.18927 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 323.196546 178.4
[M+Na]+ 345.178488 182.7
[M-H]- 321.181994 182.6
[M+NH4]+ 340.223093 192.8
[M+K]+ 361.152428 181.8
[M+H-H2O]+ 305.186530 170.0
[M+HCOO]- 367.187471 203.1
[M+CH3COO]- 381.203121 217.1
[M+Na-2H]- 343.163936 179.7
[M]+ 322.18872142 185.2
[M]- 322.18981858 185.2
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.