CID 6474926

N'-[(e)-hept-1-enyl]thiophene-2-carbohydrazide

Structural Information

Molecular Formula
C12H18N2OS
SMILES
CCCCC/C=C/NNC(=O)C1=CC=CS1
InChI
InChI=1S/C12H18N2OS/c1-2-3-4-5-6-9-13-14-12(15)11-8-7-10-16-11/h6-10,13H,2-5H2,1H3,(H,14,15)/b9-6+
InChIKey
KWGPEAZGAWGUDI-RMKNXTFCSA-N
Compound name
N'-[(E)-hept-1-enyl]thiophene-2-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

238.11398 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.12126 156.6
[M+Na]+ 261.10320 161.5
[M-H]- 237.10670 159.6
[M+NH4]+ 256.14780 175.8
[M+K]+ 277.07714 157.7
[M+H-H2O]+ 221.11124 149.5
[M+HCOO]- 283.11218 177.0
[M+CH3COO]- 297.12783 193.7
[M+Na-2H]- 259.08865 157.3
[M]+ 238.11343 158.2
[M]- 238.11453 158.2
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.