CID 1900508

15046-25-0

Structural Information

Molecular Formula
C14H13N3O3
SMILES
C1=CC=C(C=C1)C(=O)N/C(=C/C2=CC=CO2)/C(=O)NN
InChI
InChI=1S/C14H13N3O3/c15-17-14(19)12(9-11-7-4-8-20-11)16-13(18)10-5-2-1-3-6-10/h1-9H,15H2,(H,16,18)(H,17,19)/b12-9+
InChIKey
CTORJSYGWMYYMT-FMIVXFBMSA-N
Compound name
N-[(E)-1-(furan-2-yl)-3-hydrazinyl-3-oxoprop-1-en-2-yl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

271.0957 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 272.10298 162.8
[M+Na]+ 294.08492 166.6
[M-H]- 270.08842 169.5
[M+NH4]+ 289.12952 177.4
[M+K]+ 310.05886 164.9
[M+H-H2O]+ 254.09296 154.6
[M+HCOO]- 316.09390 187.6
[M+CH3COO]- 330.10955 201.1
[M+Na-2H]- 292.07037 165.8
[M]+ 271.09515 160.1
[M]- 271.09625 160.1
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

No patent data available for this compound.