CID 3040186

8-(2-hydroxy-3-isopropylamino)propoxy-3,4-dihydrocarbostyril hydrochloride

Structural Information

Molecular Formula
C15H22N2O3
SMILES
CC(C)NCC(COC1=CC=CC2=C1NC(=O)CC2)O
InChI
InChI=1S/C15H22N2O3/c1-10(2)16-8-12(18)9-20-13-5-3-4-11-6-7-14(19)17-15(11)13/h3-5,10,12,16,18H,6-9H2,1-2H3,(H,17,19)
InChIKey
BOHDOANPSBOMHL-UHFFFAOYSA-N
Compound name
8-[2-hydroxy-3-(propan-2-ylamino)propoxy]-3,4-dihydro-1H-quinolin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

278.16306 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 279.17034 165.6
[M+Na]+ 301.15228 174.4
[M+NH4]+ 296.19688 171.6
[M+K]+ 317.12622 169.6
[M-H]- 277.15578 165.8
[M+Na-2H]- 299.13773 167.8
[M]+ 278.16251 166.4
[M]- 278.16361 166.4
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

No patent data available for this compound.