CID 3047889

63868-63-3

Structural Information

Molecular Formula
C16H23NO5
SMILES
CC1C(OCCN1C(=O)C2=CC(=C(C(=C2)OC)OC)OC)C
InChI
InChI=1S/C16H23NO5/c1-10-11(2)22-7-6-17(10)16(18)12-8-13(19-3)15(21-5)14(9-12)20-4/h8-11H,6-7H2,1-5H3
InChIKey
PRWXVMWCOLOCLC-UHFFFAOYSA-N
Compound name
(2,3-dimethylmorpholin-4-yl)-(3,4,5-trimethoxyphenyl)methanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

309.15762 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 310.16490 171.7
[M+Na]+ 332.14684 183.8
[M+NH4]+ 327.19144 177.6
[M+K]+ 348.12078 179.2
[M-H]- 308.15034 175.0
[M+Na-2H]- 330.13229 175.5
[M]+ 309.15707 174.2
[M]- 309.15817 174.2
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.