CID 449190

Mesopram

Structural Information

Molecular Formula
C14H19NO4
SMILES
CCCOC1=C(C=CC(=C1)[C@@]2(CNC(=O)O2)C)OC
InChI
InChI=1S/C14H19NO4/c1-4-7-18-12-8-10(5-6-11(12)17-3)14(2)9-15-13(16)19-14/h5-6,8H,4,7,9H2,1-3H3,(H,15,16)/t14-/m0/s1
InChIKey
PCCPERGCFKIYIS-AWEZNQCLSA-N
Compound name
(5R)-5-(4-methoxy-3-propoxyphenyl)-5-methyl-1,3-oxazolidin-2-one
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

8
References

2664
Patents

265.1314 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 266.13868 158.5
[M+Na]+ 288.12062 166.4
[M-H]- 264.12412 163.4
[M+NH4]+ 283.16522 175.7
[M+K]+ 304.09456 164.9
[M+H-H2O]+ 248.12866 152.1
[M+HCOO]- 310.12960 178.1
[M+CH3COO]- 324.14525 193.1
[M+Na-2H]- 286.10607 161.9
[M]+ 265.13085 161.4
[M]- 265.13195 161.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe