CID 3088614

2-dibenzofuranol, 6,7,8,9-tetrahydro-1-((diethylamino)methyl)-, hydrochloride

Structural Information

Molecular Formula
C17H23NO2
SMILES
CCN(CC)CC1=C(C=CC2=C1C3=C(O2)CCCC3)O
InChI
InChI=1S/C17H23NO2/c1-3-18(4-2)11-13-14(19)9-10-16-17(13)12-7-5-6-8-15(12)20-16/h9-10,19H,3-8,11H2,1-2H3
InChIKey
UNOWPAJZOKSQFA-UHFFFAOYSA-N
Compound name
1-(diethylaminomethyl)-6,7,8,9-tetrahydrodibenzofuran-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

273.17288 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 274.180156 164.2
[M+Na]+ 296.162098 171.4
[M-H]- 272.165604 170.1
[M+NH4]+ 291.206703 183.2
[M+K]+ 312.136038 168.8
[M+H-H2O]+ 256.170140 157.8
[M+HCOO]- 318.171081 184.5
[M+CH3COO]- 332.186731 204.1
[M+Na-2H]- 294.147546 168.6
[M]+ 273.17233142 167.0
[M]- 273.17342858 167.0
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.