CID 13625732

2-amino-5-methylthiophene-3-carboxamide

Structural Information

Molecular Formula
C6H8N2OS
SMILES
CC1=CC(=C(S1)N)C(=O)N
InChI
InChI=1S/C6H8N2OS/c1-3-2-4(5(7)9)6(8)10-3/h2H,8H2,1H3,(H2,7,9)
InChIKey
DVGHAYAFIHAXOR-UHFFFAOYSA-N
Compound name
2-amino-5-methylthiophene-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

62
Patents

156.03574 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 157.043016 130.4
[M+Na]+ 179.024958 139.2
[M-H]- 155.028464 134.0
[M+NH4]+ 174.069563 152.9
[M+K]+ 194.998898 136.7
[M+H-H2O]+ 139.033000 125.0
[M+HCOO]- 201.033941 151.2
[M+CH3COO]- 215.049591 178.9
[M+Na-2H]- 177.010406 130.7
[M]+ 156.03519142 129.4
[M]- 156.03628858 129.4
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

patents stripe