CID 14389086

5-chlorothiophen-3-amine hydrochloride

Structural Information

Molecular Formula
C4H4ClNS
SMILES
C1=C(SC=C1N)Cl
InChI
InChI=1S/C4H4ClNS/c5-4-1-3(6)2-7-4/h1-2H,6H2
InChIKey
JBKAVYVUVXLHPJ-UHFFFAOYSA-N
Compound name
5-chlorothiophen-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

50
Patents

132.9753 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 133.98258 121.7
[M+Na]+ 155.96452 132.3
[M-H]- 131.96802 125.8
[M+NH4]+ 151.00912 146.6
[M+K]+ 171.93846 128.6
[M+H-H2O]+ 115.97256 117.9
[M+HCOO]- 177.97350 138.9
[M+CH3COO]- 191.98915 169.4
[M+Na-2H]- 153.94997 124.7
[M]+ 132.97475 123.0
[M]- 132.97585 123.0
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

patents stripe