CID 736373

N-(4-aminophenyl)thiophene-2-carboxamide

Structural Information

Molecular Formula
C11H10N2OS
SMILES
C1=CSC(=C1)C(=O)NC2=CC=C(C=C2)N
InChI
InChI=1S/C11H10N2OS/c12-8-3-5-9(6-4-8)13-11(14)10-2-1-7-15-10/h1-7H,12H2,(H,13,14)
InChIKey
JAANUULEQHTUGY-UHFFFAOYSA-N
Compound name
N-(4-aminophenyl)thiophene-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

9
References

45
Patents

218.05139 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.05867 146.0
[M+Na]+ 241.04061 153.6
[M-H]- 217.04411 152.9
[M+NH4]+ 236.08521 165.9
[M+K]+ 257.01455 149.5
[M+H-H2O]+ 201.04865 139.3
[M+HCOO]- 263.04959 167.8
[M+CH3COO]- 277.06524 188.3
[M+Na-2H]- 239.02606 148.3
[M]+ 218.05084 145.2
[M]- 218.05194 145.2
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