CID 32162

2-hydroxy-m-anisic acid 2-morpholinoethyl ester hydrochloride

Structural Information

Molecular Formula
C14H19NO5
SMILES
COC1=CC=CC(=C1O)C(=O)OCCN2CCOCC2
InChI
InChI=1S/C14H19NO5/c1-18-12-4-2-3-11(13(12)16)14(17)20-10-7-15-5-8-19-9-6-15/h2-4,16H,5-10H2,1H3
InChIKey
OARAHCVWIXQZMP-UHFFFAOYSA-N
Compound name
2-morpholin-4-ylethyl 2-hydroxy-3-methoxybenzoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

281.1263 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 282.13358 163.5
[M+Na]+ 304.11552 168.2
[M-H]- 280.11902 167.4
[M+NH4]+ 299.16012 175.6
[M+K]+ 320.08946 167.7
[M+H-H2O]+ 264.12356 155.0
[M+HCOO]- 326.12450 180.1
[M+CH3COO]- 340.14015 195.4
[M+Na-2H]- 302.10097 166.5
[M]+ 281.12575 164.2
[M]- 281.12685 164.2
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.