CID 43446598

1153515-63-9

Structural Information

Molecular Formula
C12H16N2O
SMILES
CCCN1C(=O)CCC2=C1C=CC(=C2)N
InChI
InChI=1S/C12H16N2O/c1-2-7-14-11-5-4-10(13)8-9(11)3-6-12(14)15/h4-5,8H,2-3,6-7,13H2,1H3
InChIKey
WUMCZVXYJVHZQR-UHFFFAOYSA-N
Compound name
6-amino-1-propyl-3,4-dihydroquinolin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

27
Patents

204.12627 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.13355 145.6
[M+Na]+ 227.11549 153.4
[M-H]- 203.11899 148.2
[M+NH4]+ 222.16009 164.4
[M+K]+ 243.08943 149.8
[M+H-H2O]+ 187.12353 138.7
[M+HCOO]- 249.12447 165.7
[M+CH3COO]- 263.14012 189.9
[M+Na-2H]- 225.10094 150.7
[M]+ 204.12572 143.2
[M]- 204.12682 143.2
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