CID 203197

Salicylic acid, 4-(2-morpholinoacetamido)-, methyl ester, hydrochloride

Structural Information

Molecular Formula
C14H18N2O5
SMILES
COC(=O)C1=C(C=C(C=C1)NC(=O)CN2CCOCC2)O
InChI
InChI=1S/C14H18N2O5/c1-20-14(19)11-3-2-10(8-12(11)17)15-13(18)9-16-4-6-21-7-5-16/h2-3,8,17H,4-7,9H2,1H3,(H,15,18)
InChIKey
LLWFAYHQHWJCCG-UHFFFAOYSA-N
Compound name
methyl 2-hydroxy-4-[(2-morpholin-4-ylacetyl)amino]benzoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

294.12158 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 295.128856 166.7
[M+Na]+ 317.110798 170.5
[M-H]- 293.114304 170.6
[M+NH4]+ 312.155403 177.7
[M+K]+ 333.084738 170.0
[M+H-H2O]+ 277.118840 158.0
[M+HCOO]- 339.119781 183.5
[M+CH3COO]- 353.135431 200.3
[M+Na-2H]- 315.096246 169.0
[M]+ 294.12103142 165.3
[M]- 294.12212858 165.3
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.