CID 21982381

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

Structural Information

Molecular Formula
C10H12N2O
SMILES
C1CCC2=C(C1)C=CC(=N2)C(=O)N
InChI
InChI=1S/C10H12N2O/c11-10(13)9-6-5-7-3-1-2-4-8(7)12-9/h5-6H,1-4H2,(H2,11,13)
InChIKey
QUWKKJYNNFDBPH-UHFFFAOYSA-N
Compound name
5,6,7,8-tetrahydroquinoline-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

30
Patents

176.09496 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 177.10224 136.5
[M+Na]+ 199.08418 142.9
[M-H]- 175.08768 138.7
[M+NH4]+ 194.12878 155.6
[M+K]+ 215.05812 140.2
[M+H-H2O]+ 159.09222 129.6
[M+HCOO]- 221.09316 156.2
[M+CH3COO]- 235.10881 182.4
[M+Na-2H]- 197.06963 142.9
[M]+ 176.09441 131.9
[M]- 176.09551 131.9
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