CID 9557638

N'-(2-thienylmethylene)cyclohexanecarbohydrazide

Structural Information

Molecular Formula
C12H16N2OS
SMILES
C1CCC(CC1)C(=O)N/N=C/C2=CC=CS2
InChI
InChI=1S/C12H16N2OS/c15-12(10-5-2-1-3-6-10)14-13-9-11-7-4-8-16-11/h4,7-10H,1-3,5-6H2,(H,14,15)/b13-9+
InChIKey
PPMXEVUXNSONKL-UKTHLTGXSA-N
Compound name
N-[(E)-thiophen-2-ylmethylideneamino]cyclohexanecarboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

236.09833 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 237.10561 153.6
[M+Na]+ 259.08755 157.5
[M-H]- 235.09105 160.7
[M+NH4]+ 254.13215 173.2
[M+K]+ 275.06149 154.7
[M+H-H2O]+ 219.09559 146.3
[M+HCOO]- 281.09653 173.1
[M+CH3COO]- 295.11218 192.9
[M+Na-2H]- 257.07300 154.6
[M]+ 236.09778 150.6
[M]- 236.09888 150.6
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.