CID 4607595

N'-((4-oxo-4h-chromen-3-yl)methylene)cyclohexanecarbohydrazide

Structural Information

Molecular Formula
C17H18N2O3
SMILES
C1CCC(CC1)C(=O)NN=CC2=COC3=CC=CC=C3C2=O
InChI
InChI=1S/C17H18N2O3/c20-16-13(11-22-15-9-5-4-8-14(15)16)10-18-19-17(21)12-6-2-1-3-7-12/h4-5,8-12H,1-3,6-7H2,(H,19,21)
InChIKey
GTOQRIOMLXUJJY-UHFFFAOYSA-N
Compound name
N-[(4-oxochromen-3-yl)methylideneamino]cyclohexanecarboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

298.13174 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 299.13902 168.6
[M+Na]+ 321.12096 180.6
[M+NH4]+ 316.16556 176.4
[M+K]+ 337.09490 173.4
[M-H]- 297.12446 175.2
[M+Na-2H]- 319.10641 175.2
[M]+ 298.13119 171.9
[M]- 298.13229 171.9
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.