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

8
Patents

216.12627 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 217.133546 150.1
[M+Na]+ 239.115488 159.4
[M-H]- 215.118994 156.4
[M+NH4]+ 234.160093 163.4
[M+K]+ 255.089428 154.3
[M+H-H2O]+ 199.123530 142.6
[M+HCOO]- 261.124471 170.3
[M+CH3COO]- 275.140121 161.9
[M+Na-2H]- 237.100936 154.9
[M]+ 216.12572142 149.3
[M]- 216.12681858 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