CID 209941

Propiophenone, 4'-(2-morpholinoethoxy)-, hydrochloride

Structural Information

Molecular Formula
C15H21NO3
SMILES
CCC(=O)C1=CC=C(C=C1)OCCN2CCOCC2
InChI
InChI=1S/C15H21NO3/c1-2-15(17)13-3-5-14(6-4-13)19-12-9-16-7-10-18-11-8-16/h3-6H,2,7-12H2,1H3
InChIKey
OYSQNUOSVOCLFK-UHFFFAOYSA-N
Compound name
1-[4-(2-morpholin-4-ylethoxy)phenyl]propan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

3
Patents

263.15213 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.15941 162.2
[M+Na]+ 286.14135 166.1
[M-H]- 262.14485 166.8
[M+NH4]+ 281.18595 175.4
[M+K]+ 302.11529 164.9
[M+H-H2O]+ 246.14939 153.4
[M+HCOO]- 308.15033 179.5
[M+CH3COO]- 322.16598 196.0
[M+Na-2H]- 284.12680 165.6
[M]+ 263.15158 161.7
[M]- 263.15268 161.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe