CID 3049202

Brn 1150577

Structural Information

Molecular Formula
C17H23NO4
SMILES
C1CCC(CC1)COC2=CC=C(C=C2)N3CC(OC3=O)CO
InChI
InChI=1S/C17H23NO4/c19-11-16-10-18(17(20)22-16)14-6-8-15(9-7-14)21-12-13-4-2-1-3-5-13/h6-9,13,16,19H,1-5,10-12H2
InChIKey
ZETYNNMGLBGZMI-UHFFFAOYSA-N
Compound name
3-[4-(cyclohexylmethoxy)phenyl]-5-(hydroxymethyl)-1,3-oxazolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

305.16272 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 306.17000 173.1
[M+Na]+ 328.15194 183.5
[M+NH4]+ 323.19654 179.9
[M+K]+ 344.12588 179.5
[M-H]- 304.15544 177.9
[M+Na-2H]- 326.13739 177.5
[M]+ 305.16217 175.6
[M]- 305.16327 175.6
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.