CID 135521358

Nsc646832

Structural Information

Molecular Formula
C23H20N2O3
SMILES
CC(C1C2=CC=CC=C2OC1=O)/C(=N/NC3=CC=CC=C3)/C4=CC=C(C=C4)O
InChI
InChI=1S/C23H20N2O3/c1-15(21-19-9-5-6-10-20(19)28-23(21)27)22(16-11-13-18(26)14-12-16)25-24-17-7-3-2-4-8-17/h2-15,21,24,26H,1H3/b25-22-
InChIKey
QFIOQZMUCYTKEW-LVWGJNHUSA-N
Compound name
3-[(1Z)-1-(4-hydroxyphenyl)-1-(phenylhydrazinylidene)propan-2-yl]-3H-1-benzofuran-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

372.1474 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 373.15468 188.4
[M+Na]+ 395.13662 193.3
[M-H]- 371.14012 199.5
[M+NH4]+ 390.18122 200.4
[M+K]+ 411.11056 189.4
[M+H-H2O]+ 355.14466 179.2
[M+HCOO]- 417.14560 210.1
[M+CH3COO]- 431.16125 198.3
[M+Na-2H]- 393.12207 190.7
[M]+ 372.14685 188.0
[M]- 372.14795 188.0
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.