CID 2736964

175203-20-0

Structural Information

Molecular Formula
C8H6F2O
SMILES
C1COC2=C1C=C(C=C2F)F
InChI
InChI=1S/C8H6F2O/c9-6-3-5-1-2-11-8(5)7(10)4-6/h3-4H,1-2H2
InChIKey
UTACBIJGRPIWCG-UHFFFAOYSA-N
Compound name
5,7-difluoro-2,3-dihydro-1-benzofuran
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

156.03867 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 157.045946 124.5
[M+Na]+ 179.027888 134.9
[M-H]- 155.031394 127.7
[M+NH4]+ 174.072493 147.5
[M+K]+ 195.001828 133.4
[M+H-H2O]+ 139.035930 118.3
[M+HCOO]- 201.036871 145.9
[M+CH3COO]- 215.052521 175.7
[M+Na-2H]- 177.013336 131.5
[M]+ 156.03812142 122.8
[M]- 156.03921858 122.8
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