CID 51102

70551-92-7

Structural Information

Molecular Formula
C15H19N5O
SMILES
CCCCCC(=O)NNC1=NC(=CN=N1)C2=CC=CC=C2
InChI
InChI=1S/C15H19N5O/c1-2-3-5-10-14(21)18-20-15-17-13(11-16-19-15)12-8-6-4-7-9-12/h4,6-9,11H,2-3,5,10H2,1H3,(H,18,21)(H,17,19,20)
InChIKey
NCLOKYNWTNYNHH-UHFFFAOYSA-N
Compound name
N'-(5-phenyl-1,2,4-triazin-3-yl)hexanehydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

285.15897 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 286.16625 167.3
[M+Na]+ 308.14819 172.7
[M-H]- 284.15169 169.5
[M+NH4]+ 303.19279 177.9
[M+K]+ 324.12213 168.1
[M+H-H2O]+ 268.15623 156.4
[M+HCOO]- 330.15717 188.8
[M+CH3COO]- 344.17282 205.6
[M+Na-2H]- 306.13364 174.3
[M]+ 285.15842 167.2
[M]- 285.15952 167.2
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

patents stripe