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]+ 344.150576 176.4
[M+Na]+ 366.132518 183.3
[M-H]- 342.136024 184.3
[M+NH4]+ 361.177123 186.2
[M+K]+ 382.106458 176.1
[M+H-H2O]+ 326.140560 164.6
[M+HCOO]- 388.141501 200.3
[M+CH3COO]- 402.157151 186.2
[M+Na-2H]- 364.117966 187.0
[M]+ 343.14275142 174.5
[M]- 343.14384858 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.