CID 60774268

6-amino-1-(cyclopropylmethyl)-1,2,3,4-tetrahydroquinolin-2-one

Structural Information

Molecular Formula
C13H16N2O
SMILES
C1CC1CN2C(=O)CCC3=C2C=CC(=C3)N
InChI
InChI=1S/C13H16N2O/c14-11-4-5-12-10(7-11)3-6-13(16)15(12)8-9-1-2-9/h4-5,7,9H,1-3,6,8,14H2
InChIKey
WNOIXLXOSIYWCF-UHFFFAOYSA-N
Compound name
6-amino-1-(cyclopropylmethyl)-3,4-dihydroquinolin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

216.12627 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 217.13355 150.1
[M+Na]+ 239.11549 159.4
[M-H]- 215.11899 156.4
[M+NH4]+ 234.16009 163.4
[M+K]+ 255.08943 154.3
[M+H-H2O]+ 199.12353 142.6
[M+HCOO]- 261.12447 170.3
[M+CH3COO]- 275.14012 161.9
[M+Na-2H]- 237.10094 154.9
[M]+ 216.12572 149.3
[M]- 216.12682 149.3
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