CID 3043538

Dihydro-3-(4-morpholinylmethyl)-4-phenyl-2(3h)-furanone

Structural Information

Molecular Formula
C15H19NO3
SMILES
C1COCCN1CC2C(COC2=O)C3=CC=CC=C3
InChI
InChI=1S/C15H19NO3/c17-15-13(10-16-6-8-18-9-7-16)14(11-19-15)12-4-2-1-3-5-12/h1-5,13-14H,6-11H2
InChIKey
JOMAPGOMSKHXCK-UHFFFAOYSA-N
Compound name
3-(morpholin-4-ylmethyl)-4-phenyloxolan-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

261.1365 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 262.14378 159.8
[M+Na]+ 284.12572 164.3
[M-H]- 260.12922 168.3
[M+NH4]+ 279.17032 173.5
[M+K]+ 300.09966 163.5
[M+H-H2O]+ 244.13376 151.6
[M+HCOO]- 306.13470 176.4
[M+CH3COO]- 320.15035 170.9
[M+Na-2H]- 282.11117 161.9
[M]+ 261.13595 156.3
[M]- 261.13705 156.3
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.