CID 39318

4-(dimethylamino)methyl-3-methoxydibenzofuran

Structural Information

Molecular Formula
C16H17NO2
SMILES
CN(C)CC1=C(C=CC2=C1OC3=CC=CC=C23)OC
InChI
InChI=1S/C16H17NO2/c1-17(2)10-13-14(18-3)9-8-12-11-6-4-5-7-15(11)19-16(12)13/h4-9H,10H2,1-3H3
InChIKey
NXYJWKVEXIRWMP-UHFFFAOYSA-N
Compound name
1-(3-methoxydibenzofuran-4-yl)-N,N-dimethylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

255.12593 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.13321 157.3
[M+Na]+ 278.11515 167.4
[M-H]- 254.11865 165.6
[M+NH4]+ 273.15975 177.9
[M+K]+ 294.08909 165.7
[M+H-H2O]+ 238.12319 150.8
[M+HCOO]- 300.12413 182.4
[M+CH3COO]- 314.13978 171.6
[M+Na-2H]- 276.10060 164.5
[M]+ 255.12538 164.5
[M]- 255.12648 164.5
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.