CID 377319

Nsc658719

Structural Information

Molecular Formula
C15H13N5
SMILES
C1=CC=C2C(=C1)C3=CC=CC=C3C24C(=NC(=NN4)N)N
InChI
InChI=1S/C15H13N5/c16-13-15(20-19-14(17)18-13)11-7-3-1-5-9(11)10-6-2-4-8-12(10)15/h1-8,20H,(H4,16,17,18,19)
InChIKey
CFDOVBZFWVYTGX-UHFFFAOYSA-N
Compound name
spiro[1H-1,2,4-triazine-6,9'-fluorene]-3,5-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

263.1171 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.12438 157.6
[M+Na]+ 286.10632 168.3
[M-H]- 262.10982 160.2
[M+NH4]+ 281.15092 175.0
[M+K]+ 302.08026 160.8
[M+H-H2O]+ 246.11436 148.7
[M+HCOO]- 308.11530 176.2
[M+CH3COO]- 322.13095 168.7
[M+Na-2H]- 284.09177 165.9
[M]+ 263.11655 153.2
[M]- 263.11765 153.2
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.