CID 215146

35076-10-9

Structural Information

Molecular Formula
C15H16ClNO4
SMILES
C1CC(OC1=O)(C2=CC=C(C=C2)Cl)C(=O)N3CCOCC3
InChI
InChI=1S/C15H16ClNO4/c16-12-3-1-11(2-4-12)15(6-5-13(18)21-15)14(19)17-7-9-20-10-8-17/h1-4H,5-10H2
InChIKey
RKHNNZHFZAATOA-UHFFFAOYSA-N
Compound name
5-(4-chlorophenyl)-5-(morpholine-4-carbonyl)oxolan-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

309.07678 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 310.08406 167.2
[M+Na]+ 332.06600 179.3
[M+NH4]+ 327.11060 176.0
[M+K]+ 348.03994 173.8
[M-H]- 308.06950 173.4
[M+Na-2H]- 330.05145 173.8
[M]+ 309.07623 171.0
[M]- 309.07733 171.0
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.