CID 18229

3,4-dihydro-1-(2-(dimethylamino)ethyl)carbostyril hydrochloride

Structural Information

Molecular Formula
C13H18N2O
SMILES
CN(C)CCN1C(=O)CCC2=CC=CC=C21
InChI
InChI=1S/C13H18N2O/c1-14(2)9-10-15-12-6-4-3-5-11(12)7-8-13(15)16/h3-6H,7-10H2,1-2H3
InChIKey
DPCBQEZRQXVNJH-UHFFFAOYSA-N
Compound name
1-[2-(dimethylamino)ethyl]-3,4-dihydroquinolin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

218.1419 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.14918 149.4
[M+Na]+ 241.13112 155.8
[M-H]- 217.13462 153.3
[M+NH4]+ 236.17572 168.1
[M+K]+ 257.10506 153.7
[M+H-H2O]+ 201.13916 141.7
[M+HCOO]- 263.14010 170.2
[M+CH3COO]- 277.15575 195.9
[M+Na-2H]- 239.11657 155.0
[M]+ 218.14135 149.1
[M]- 218.14245 149.1
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