CID 135409203

Nsc666168

Structural Information

Molecular Formula
C15H10N6O
SMILES
C1=CC=C2C(=C1)C3=CC=CC=C3C24C(=O)NC(=NN4)N=[N+]=[N-]
InChI
InChI=1S/C15H10N6O/c16-21-19-14-17-13(22)15(20-18-14)11-7-3-1-5-9(11)10-6-2-4-8-12(10)15/h1-8,20H,(H,17,18,22)
InChIKey
GMAPHHUUSLWAEB-UHFFFAOYSA-N
Compound name
3-azidospiro[1,4-dihydro-1,2,4-triazine-6,9'-fluorene]-5-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

290.0916 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.09888 158.7
[M+Na]+ 313.08082 167.1
[M-H]- 289.08432 162.7
[M+NH4]+ 308.12542 174.7
[M+K]+ 329.05476 155.5
[M+H-H2O]+ 273.08886 153.0
[M+HCOO]- 335.08980 180.3
[M+CH3COO]- 349.10545 197.9
[M+Na-2H]- 311.06627 171.5
[M]+ 290.09105 152.3
[M]- 290.09215 152.3
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.