CID 3069810

Brn 1472798

Structural Information

Molecular Formula
C16H22N2O2
SMILES
CCN(CC)CC(COC1=CC=CC2=C1N=CC=C2)O
InChI
InChI=1S/C16H22N2O2/c1-3-18(4-2)11-14(19)12-20-15-9-5-7-13-8-6-10-17-16(13)15/h5-10,14,19H,3-4,11-12H2,1-2H3
InChIKey
FCHUHYJBMDOTEP-UHFFFAOYSA-N
Compound name
1-(diethylamino)-3-quinolin-8-yloxypropan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

274.16812 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 275.17540 165.6
[M+Na]+ 297.15734 170.6
[M-H]- 273.16084 167.9
[M+NH4]+ 292.20194 181.0
[M+K]+ 313.13128 168.2
[M+H-H2O]+ 257.16538 157.2
[M+HCOO]- 319.16632 185.8
[M+CH3COO]- 333.18197 204.2
[M+Na-2H]- 295.14279 170.6
[M]+ 274.16757 168.5
[M]- 274.16867 168.5
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