CID 63210

16802-76-9

Structural Information

Molecular Formula
C20H17N5O
SMILES
C1=CC=C(C=C1)NNC2=NC3=CC=CC=C3C(=O)N2NC4=CC=CC=C4
InChI
InChI=1S/C20H17N5O/c26-19-17-13-7-8-14-18(17)21-20(23-22-15-9-3-1-4-10-15)25(19)24-16-11-5-2-6-12-16/h1-14,22,24H,(H,21,23)
InChIKey
FARFHCCTCHEBKP-UHFFFAOYSA-N
Compound name
3-anilino-2-(2-phenylhydrazinyl)quinazolin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

343.1433 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 344.15058 176.4
[M+Na]+ 366.13252 183.3
[M-H]- 342.13602 184.3
[M+NH4]+ 361.17712 186.2
[M+K]+ 382.10646 176.1
[M+H-H2O]+ 326.14056 164.6
[M+HCOO]- 388.14150 200.3
[M+CH3COO]- 402.15715 186.2
[M+Na-2H]- 364.11797 187.0
[M]+ 343.14275 174.5
[M]- 343.14385 174.5
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.