CID 2451355

Diphenyl-1h-1,2,4-triazole-3-carbohydrazide

Structural Information

Molecular Formula
C15H13N5O
SMILES
C1=CC=C(C=C1)C2=NC(=NN2C3=CC=CC=C3)C(=O)NN
InChI
InChI=1S/C15H13N5O/c16-18-15(21)13-17-14(11-7-3-1-4-8-11)20(19-13)12-9-5-2-6-10-12/h1-10H,16H2,(H,18,21)
InChIKey
SZMLCDPIFRXCDE-UHFFFAOYSA-N
Compound name
1,5-diphenyl-1,2,4-triazole-3-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

279.112 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 280.11928 161.9
[M+Na]+ 302.10122 169.4
[M-H]- 278.10472 168.1
[M+NH4]+ 297.14582 174.2
[M+K]+ 318.07516 164.2
[M+H-H2O]+ 262.10926 151.3
[M+HCOO]- 324.11020 185.1
[M+CH3COO]- 338.12585 172.9
[M+Na-2H]- 300.08667 167.1
[M]+ 279.11145 159.7
[M]- 279.11255 159.7
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.