CID 116525

64059-58-1

Structural Information

Molecular Formula
C14H19NO5
SMILES
COC1=C(C(=C(C=C1)C(=O)N2CCOCC2)OC)OC
InChI
InChI=1S/C14H19NO5/c1-17-11-5-4-10(12(18-2)13(11)19-3)14(16)15-6-8-20-9-7-15/h4-5H,6-9H2,1-3H3
InChIKey
FIZQWEUHBSXRFR-UHFFFAOYSA-N
Compound name
morpholin-4-yl-(2,3,4-trimethoxyphenyl)methanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

281.1263 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 282.133576 162.8
[M+Na]+ 304.115518 168.9
[M-H]- 280.119024 168.5
[M+NH4]+ 299.160123 176.0
[M+K]+ 320.089458 169.3
[M+H-H2O]+ 264.123560 154.4
[M+HCOO]- 326.124501 180.9
[M+CH3COO]- 340.140151 199.1
[M+Na-2H]- 302.100966 165.7
[M]+ 281.12575142 165.8
[M]- 281.12684858 165.8
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

patents stripe