CID 45054892

4-((4-methylbenzyl)oxy)-n'-(2-thienylmethylene)benzohydrazide

Structural Information

Molecular Formula
C20H18N2O2S
SMILES
CC1=CC=C(C=C1)COC2=CC=C(C=C2)C(=O)N/N=C/C3=CC=CS3
InChI
InChI=1S/C20H18N2O2S/c1-15-4-6-16(7-5-15)14-24-18-10-8-17(9-11-18)20(23)22-21-13-19-3-2-12-25-19/h2-13H,14H2,1H3,(H,22,23)/b21-13+
InChIKey
VHGNYUXIEZKAJB-FYJGNVAPSA-N
Compound name
4-[(4-methylphenyl)methoxy]-N-[(E)-thiophen-2-ylmethylideneamino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

350.1089 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 351.11618 183.2
[M+Na]+ 373.09812 195.7
[M+NH4]+ 368.14272 191.5
[M+K]+ 389.07206 186.9
[M-H]- 349.10162 190.5
[M+Na-2H]- 371.08357 193.0
[M]+ 350.10835 187.5
[M]- 350.10945 187.5
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.