CID 83397410

7-bromo-5-fluoro-2,3-dihydro-1-benzofuran

Structural Information

Molecular Formula
C8H6BrFO
SMILES
C1COC2=C1C=C(C=C2Br)F
InChI
InChI=1S/C8H6BrFO/c9-7-4-6(10)3-5-1-2-11-8(5)7/h3-4H,1-2H2
InChIKey
YMTDRJZBYRHXTD-UHFFFAOYSA-N
Compound name
7-bromo-5-fluoro-2,3-dihydro-1-benzofuran
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
Patents

215.9586 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.965876 139.0
[M+Na]+ 238.947818 152.3
[M-H]- 214.951324 146.0
[M+NH4]+ 233.992423 163.0
[M+K]+ 254.921758 142.7
[M+H-H2O]+ 198.955860 139.6
[M+HCOO]- 260.956801 159.0
[M+CH3COO]- 274.972451 155.2
[M+Na-2H]- 236.933266 146.8
[M]+ 215.95805142 156.9
[M]- 215.95914858 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

patents stripe