CID 59039

2-(1-morpholinomethyl)-4-phenoxyfuran hydrochloride

Structural Information

Molecular Formula
C15H17NO3
SMILES
C1COCCN1CC2=CC(=CO2)OC3=CC=CC=C3
InChI
InChI=1S/C15H17NO3/c1-2-4-13(5-3-1)19-15-10-14(18-12-15)11-16-6-8-17-9-7-16/h1-5,10,12H,6-9,11H2
InChIKey
LFKRMSIDNYTTMQ-UHFFFAOYSA-N
Compound name
4-[(4-phenoxyfuran-2-yl)methyl]morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

259.12085 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 260.128126 157.3
[M+Na]+ 282.110068 162.7
[M-H]- 258.113574 166.2
[M+NH4]+ 277.154673 171.0
[M+K]+ 298.084008 162.1
[M+H-H2O]+ 242.118110 148.8
[M+HCOO]- 304.119051 176.6
[M+CH3COO]- 318.134701 169.1
[M+Na-2H]- 280.095516 162.1
[M]+ 259.12030142 156.9
[M]- 259.12139858 156.9
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.