CID 208650

N'-phenylchromone-carbohydrazide-2

Structural Information

Molecular Formula
C16H12N2O3
SMILES
C1=CC=C(C=C1)NNC(=O)C2=CC(=O)C3=CC=CC=C3O2
InChI
InChI=1S/C16H12N2O3/c19-13-10-15(21-14-9-5-4-8-12(13)14)16(20)18-17-11-6-2-1-3-7-11/h1-10,17H,(H,18,20)
InChIKey
NHZGYKUCNXDMDH-UHFFFAOYSA-N
Compound name
4-oxo-N'-phenylchromene-2-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

280.08478 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 281.09206 160.3
[M+Na]+ 303.07400 167.8
[M-H]- 279.07750 168.9
[M+NH4]+ 298.11860 174.9
[M+K]+ 319.04794 164.9
[M+H-H2O]+ 263.08204 151.7
[M+HCOO]- 325.08298 184.9
[M+CH3COO]- 339.09863 172.6
[M+Na-2H]- 301.05945 169.5
[M]+ 280.08423 161.0
[M]- 280.08533 161.0
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

patents stripe