CID 58099

2,3-dimethyl-6-morpholinomethyl-chromone hydrochloride

Structural Information

Molecular Formula
C16H19NO3
SMILES
CC1=C(OC2=C(C1=O)C=C(C=C2)CN3CCOCC3)C
InChI
InChI=1S/C16H19NO3/c1-11-12(2)20-15-4-3-13(9-14(15)16(11)18)10-17-5-7-19-8-6-17/h3-4,9H,5-8,10H2,1-2H3
InChIKey
COVQREGUXDTNJO-UHFFFAOYSA-N
Compound name
2,3-dimethyl-6-(morpholin-4-ylmethyl)chromen-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

273.1365 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 274.14378 162.2
[M+Na]+ 296.12572 177.7
[M+NH4]+ 291.17032 170.6
[M+K]+ 312.09966 170.6
[M-H]- 272.12922 169.2
[M+Na-2H]- 294.11117 168.3
[M]+ 273.13595 166.5
[M]- 273.13705 166.5
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

No patent data available for this compound.