CID 3040192

5-(2-hydroxy-3-ethylamino)propoxy-3,4-dihydrocarbostyril maleate (1:1)

Structural Information

Molecular Formula
C14H20N2O3
SMILES
CCNCC(COC1=CC=CC2=C1CCC(=O)N2)O
InChI
InChI=1S/C14H20N2O3/c1-2-15-8-10(17)9-19-13-5-3-4-12-11(13)6-7-14(18)16-12/h3-5,10,15,17H,2,6-9H2,1H3,(H,16,18)
InChIKey
UWENXWFVSDDGMY-UHFFFAOYSA-N
Compound name
5-[3-(ethylamino)-2-hydroxypropoxy]-3,4-dihydro-1H-quinolin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

264.1474 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 265.15468 160.4
[M+Na]+ 287.13662 164.8
[M-H]- 263.14012 159.8
[M+NH4]+ 282.18122 174.8
[M+K]+ 303.11056 161.1
[M+H-H2O]+ 247.14466 153.0
[M+HCOO]- 309.14560 176.7
[M+CH3COO]- 323.16125 195.8
[M+Na-2H]- 285.12207 164.2
[M]+ 264.14685 157.8
[M]- 264.14795 157.8
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.