CID 135804070

1-azafluorenone semicarbazone

Structural Information

Molecular Formula
C13H10N4O
SMILES
C1=CC=C2C(=C1)C3=CC=CNC3=C2N=NC(=O)N
InChI
InChI=1S/C13H10N4O/c14-13(18)17-16-12-10-5-2-1-4-8(10)9-6-3-7-15-11(9)12/h1-7,15H,(H2,14,18)
InChIKey
QWKWZBMVPBEQMA-UHFFFAOYSA-N
Compound name
1H-indeno[2,1-b]pyridin-9-yliminourea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

238.08546 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.09274 150.0
[M+Na]+ 261.07468 162.2
[M+NH4]+ 256.11928 158.5
[M+K]+ 277.04862 157.2
[M-H]- 237.07818 154.0
[M+Na-2H]- 259.06013 157.0
[M]+ 238.08491 152.6
[M]- 238.08601 152.6
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.