CID 81755

2-methyldibenzofuran

Structural Information

Molecular Formula
C13H10O
SMILES
CC1=CC2=C(C=C1)OC3=CC=CC=C32
InChI
InChI=1S/C13H10O/c1-9-6-7-13-11(8-9)10-4-2-3-5-12(10)14-13/h2-8H,1H3
InChIKey
VTKMFJSESAHMLR-UHFFFAOYSA-N
Compound name
2-methyldibenzofuran
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1705
Patents

182.07317 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.08045 134.3
[M+Na]+ 205.06239 151.2
[M+NH4]+ 200.10699 145.8
[M+K]+ 221.03633 144.4
[M-H]- 181.06589 140.3
[M+Na-2H]- 203.04784 142.8
[M]+ 182.07262 138.8
[M]- 182.07372 138.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe