CID 130590796

5,6,7,8-tetrahydroquinoline-2-carbothioamide

Structural Information

Molecular Formula
C10H12N2S
SMILES
C1CCC2=C(C1)C=CC(=N2)C(=S)N
InChI
InChI=1S/C10H12N2S/c11-10(13)9-6-5-7-3-1-2-4-8(7)12-9/h5-6H,1-4H2,(H2,11,13)
InChIKey
KLYFVRAFSBETEZ-UHFFFAOYSA-N
Compound name
5,6,7,8-tetrahydroquinoline-2-carbothioamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

192.07211 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.07939 138.9
[M+Na]+ 215.06133 150.5
[M+NH4]+ 210.10593 148.7
[M+K]+ 231.03527 141.9
[M-H]- 191.06483 142.1
[M+Na-2H]- 213.04678 144.7
[M]+ 192.07156 141.8
[M]- 192.07266 141.8
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.