CID 1240486

4-dibenzofuranol, 6,7,8,9-tetrahydro-3-(4-morpholinylmethyl)-, hydrochloride

Structural Information

Molecular Formula
C17H21NO3
SMILES
C1CCC2=C(C1)C3=C(O2)C(=C(C=C3)CN4CCOCC4)O
InChI
InChI=1S/C17H21NO3/c19-16-12(11-18-7-9-20-10-8-18)5-6-14-13-3-1-2-4-15(13)21-17(14)16/h5-6,19H,1-4,7-11H2
InChIKey
IFANRYFRMFAZHI-UHFFFAOYSA-N
Compound name
3-(morpholin-4-ylmethyl)-6,7,8,9-tetrahydrodibenzofuran-4-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

287.15213 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 288.15941 164.3
[M+Na]+ 310.14135 170.7
[M-H]- 286.14485 170.7
[M+NH4]+ 305.18595 178.9
[M+K]+ 326.11529 168.1
[M+H-H2O]+ 270.14939 156.6
[M+HCOO]- 332.15033 178.1
[M+CH3COO]- 346.16598 175.0
[M+Na-2H]- 308.12680 168.4
[M]+ 287.15158 162.3
[M]- 287.15268 162.3
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.