CID 10081242

N-(1,2,3,4-tetrahydroquinolin-5-yl)acetamide

Structural Information

Molecular Formula
C11H14N2O
SMILES
CC(=O)NC1=CC=CC2=C1CCCN2
InChI
InChI=1S/C11H14N2O/c1-8(14)13-11-6-2-5-10-9(11)4-3-7-12-10/h2,5-6,12H,3-4,7H2,1H3,(H,13,14)
InChIKey
OPCOPOQVNHAIHJ-UHFFFAOYSA-N
Compound name
N-(1,2,3,4-tetrahydroquinolin-5-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

30
Patents

190.11061 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.117886 141.1
[M+Na]+ 213.099828 146.7
[M-H]- 189.103334 142.3
[M+NH4]+ 208.144433 159.3
[M+K]+ 229.073768 143.3
[M+H-H2O]+ 173.107870 134.3
[M+HCOO]- 235.108811 159.6
[M+CH3COO]- 249.124461 182.9
[M+Na-2H]- 211.085276 147.6
[M]+ 190.11006142 135.9
[M]- 190.11115858 135.9
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