CID 3061305

Brn 4701058

Structural Information

Molecular Formula
C14H12N4O2
SMILES
C1C(=NC2=CC=CC=C2O1)NNC(=O)C3=CC=CC=N3
InChI
InChI=1S/C14H12N4O2/c19-14(11-6-3-4-8-15-11)18-17-13-9-20-12-7-2-1-5-10(12)16-13/h1-8H,9H2,(H,16,17)(H,18,19)
InChIKey
BXTNPDICFRVVTL-UHFFFAOYSA-N
Compound name
N'-(2H-1,4-benzoxazin-3-yl)pyridine-2-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

268.09604 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.10332 158.4
[M+Na]+ 291.08526 164.9
[M-H]- 267.08876 163.7
[M+NH4]+ 286.12986 170.6
[M+K]+ 307.05920 161.9
[M+H-H2O]+ 251.09330 148.4
[M+HCOO]- 313.09424 179.3
[M+CH3COO]- 327.10989 169.3
[M+Na-2H]- 289.07071 168.7
[M]+ 268.09549 156.7
[M]- 268.09659 156.7
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.