CID 132371553

5-bromo-3-(bromomethyl)-2,3-dihydro-1-benzofuran

Structural Information

Molecular Formula
C9H8Br2O
SMILES
C1C(C2=C(O1)C=CC(=C2)Br)CBr
InChI
InChI=1S/C9H8Br2O/c10-4-6-5-12-9-2-1-7(11)3-8(6)9/h1-3,6H,4-5H2
InChIKey
KKNOXMSKBCDJKA-UHFFFAOYSA-N
Compound name
5-bromo-3-(bromomethyl)-2,3-dihydro-1-benzofuran
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

289.8942 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 290.90148 152.8
[M+Na]+ 312.88342 147.9
[M+NH4]+ 307.92802 155.5
[M+K]+ 328.85736 154.6
[M-H]- 288.88692 154.4
[M+Na-2H]- 310.86887 153.2
[M]+ 289.89365 151.5
[M]- 289.89475 151.5
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.