CID 5911055

468073-59-8

Structural Information

Molecular Formula
C15H15N3O3
SMILES
CC1=CC=C(C=C1)C(=O)NCC(=O)N/N=C/C2=CC=CO2
InChI
InChI=1S/C15H15N3O3/c1-11-4-6-12(7-5-11)15(20)16-10-14(19)18-17-9-13-3-2-8-21-13/h2-9H,10H2,1H3,(H,16,20)(H,18,19)/b17-9+
InChIKey
ULACVUKTHCASRS-RQZCQDPDSA-N
Compound name
N-[2-[(2E)-2-(furan-2-ylmethylidene)hydrazinyl]-2-oxoethyl]-4-methylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

285.11133 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 286.11861 168.0
[M+Na]+ 308.10055 177.0
[M+NH4]+ 303.14515 174.0
[M+K]+ 324.07449 173.7
[M-H]- 284.10405 172.9
[M+Na-2H]- 306.08600 173.9
[M]+ 285.11078 170.2
[M]- 285.11188 170.2
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.