CID 6877416

3-chloro-n'-(2-thienylmethylene)benzohydrazide

Structural Information

Molecular Formula
C12H9ClN2OS
SMILES
C1=CC(=CC(=C1)Cl)C(=O)N/N=C/C2=CC=CS2
InChI
InChI=1S/C12H9ClN2OS/c13-10-4-1-3-9(7-10)12(16)15-14-8-11-5-2-6-17-11/h1-8H,(H,15,16)/b14-8+
InChIKey
PGCLUXCFPDLOLH-RIYZIHGNSA-N
Compound name
3-chloro-N-[(E)-thiophen-2-ylmethylideneamino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

264.01242 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 265.01970 157.5
[M+Na]+ 287.00164 169.7
[M+NH4]+ 282.04624 166.8
[M+K]+ 302.97558 161.5
[M-H]- 263.00514 162.7
[M+Na-2H]- 284.98709 165.8
[M]+ 264.01187 161.4
[M]- 264.01297 161.4
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.