CID 3394089

5-(chloromethyl)-2-(2,4-dimethoxyphenyl)-1,3-oxazolidine

Structural Information

Molecular Formula
C12H16ClNO3
SMILES
COC1=CC(=C(C=C1)C2NCC(O2)CCl)OC
InChI
InChI=1S/C12H16ClNO3/c1-15-8-3-4-10(11(5-8)16-2)12-14-7-9(6-13)17-12/h3-5,9,12,14H,6-7H2,1-2H3
InChIKey
CQHZVDXJJIDZJS-UHFFFAOYSA-N
Compound name
5-(chloromethyl)-2-(2,4-dimethoxyphenyl)-1,3-oxazolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

257.08188 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 258.08916 155.2
[M+Na]+ 280.07110 167.8
[M+NH4]+ 275.11570 163.0
[M+K]+ 296.04504 163.5
[M-H]- 256.07460 158.7
[M+Na-2H]- 278.05655 160.3
[M]+ 257.08133 158.2
[M]- 257.08243 158.2
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.