CID 2060878

4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide

Structural Information

Molecular Formula
C9H12N2OS
SMILES
C1CCC2=C(C1)C=C(S2)C(=O)NN
InChI
InChI=1S/C9H12N2OS/c10-11-9(12)8-5-6-3-1-2-4-7(6)13-8/h5H,1-4,10H2,(H,11,12)
InChIKey
SDFUELDJXIFNSG-UHFFFAOYSA-N
Compound name
4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

196.06703 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 197.07431 140.0
[M+Na]+ 219.05625 148.1
[M+NH4]+ 214.10085 149.2
[M+K]+ 235.03019 142.7
[M-H]- 195.05975 142.7
[M+Na-2H]- 217.04170 143.8
[M]+ 196.06648 142.0
[M]- 196.06758 142.0
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.