CID 25941

N,n-diethyl-5-oxo-2-phenyltetrahydro-2-furamide

Structural Information

Molecular Formula
C15H19NO3
SMILES
CCN(CC)C(=O)C1(CCC(=O)O1)C2=CC=CC=C2
InChI
InChI=1S/C15H19NO3/c1-3-16(4-2)14(18)15(11-10-13(17)19-15)12-8-6-5-7-9-12/h5-9H,3-4,10-11H2,1-2H3
InChIKey
ZVLBDLCCXMLUCX-UHFFFAOYSA-N
Compound name
N,N-diethyl-5-oxo-2-phenyloxolane-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

261.1365 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 262.14378 160.5
[M+Na]+ 284.12572 166.0
[M-H]- 260.12922 168.8
[M+NH4]+ 279.17032 179.6
[M+K]+ 300.09966 165.9
[M+H-H2O]+ 244.13376 154.0
[M+HCOO]- 306.13470 183.1
[M+CH3COO]- 320.15035 199.3
[M+Na-2H]- 282.11117 163.5
[M]+ 261.13595 161.9
[M]- 261.13705 161.9
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.