CID 135521366

3-(2-(2-hydroxyphenyl)-2-(phenylhydrazono)ethyl)-1-benzofuran-2(3h)-one

Structural Information

Molecular Formula
C22H18N2O3
SMILES
C1=CC=C(C=C1)N/N=C(/CC2C3=CC=CC=C3OC2=O)\C4=CC=CC=C4O
InChI
InChI=1S/C22H18N2O3/c25-20-12-6-4-11-17(20)19(24-23-15-8-2-1-3-9-15)14-18-16-10-5-7-13-21(16)27-22(18)26/h1-13,18,23,25H,14H2/b24-19-
InChIKey
WUJJORNPCJIZED-CLCOLTQESA-N
Compound name
3-[(2Z)-2-(2-hydroxyphenyl)-2-(phenylhydrazinylidene)ethyl]-3H-1-benzofuran-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

358.13174 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 359.13902 183.2
[M+Na]+ 381.12096 188.9
[M-H]- 357.12446 194.4
[M+NH4]+ 376.16556 195.9
[M+K]+ 397.09490 184.6
[M+H-H2O]+ 341.12900 174.0
[M+HCOO]- 403.12994 206.2
[M+CH3COO]- 417.14559 193.7
[M+Na-2H]- 379.10641 187.2
[M]+ 358.13119 183.1
[M]- 358.13229 183.1
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.