CID 468648

Thiophene-3-carbohydrazide

Structural Information

Molecular Formula
C5H6N2OS
SMILES
C1=CSC=C1C(=O)NN
InChI
InChI=1S/C5H6N2OS/c6-7-5(8)4-1-2-9-3-4/h1-3H,6H2,(H,7,8)
InChIKey
AMOWAJLALKAYKL-UHFFFAOYSA-N
Compound name
thiophene-3-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

104
Patents

142.02008 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.02736 126.3
[M+Na]+ 165.00930 133.9
[M-H]- 141.01280 130.0
[M+NH4]+ 160.05390 149.1
[M+K]+ 180.98324 132.0
[M+H-H2O]+ 125.01734 120.5
[M+HCOO]- 187.01828 148.1
[M+CH3COO]- 201.03393 173.5
[M+Na-2H]- 162.99475 129.4
[M]+ 142.01953 125.1
[M]- 142.02063 125.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe