CID 3061292

Brn 4704180

Structural Information

Molecular Formula
C16H15N3O2
SMILES
C1C(=NC2=CC=CC=C2O1)NNC(=O)CC3=CC=CC=C3
InChI
InChI=1S/C16H15N3O2/c20-16(10-12-6-2-1-3-7-12)19-18-15-11-21-14-9-5-4-8-13(14)17-15/h1-9H,10-11H2,(H,17,18)(H,19,20)
InChIKey
CDURWUBQNVFIFI-UHFFFAOYSA-N
Compound name
N'-(2H-1,4-benzoxazin-3-yl)-2-phenylacetohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

281.11642 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 282.12370 162.9
[M+Na]+ 304.10564 168.5
[M-H]- 280.10914 169.3
[M+NH4]+ 299.15024 176.0
[M+K]+ 320.07958 165.4
[M+H-H2O]+ 264.11368 153.4
[M+HCOO]- 326.11462 184.4
[M+CH3COO]- 340.13027 173.7
[M+Na-2H]- 302.09109 172.0
[M]+ 281.11587 161.4
[M]- 281.11697 161.4
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.