CID 17819860

6-fluoro-1h-indene

Structural Information

Molecular Formula
C9H7F
SMILES
C1C=CC2=C1C=C(C=C2)F
InChI
InChI=1S/C9H7F/c10-9-5-4-7-2-1-3-8(7)6-9/h1-2,4-6H,3H2
InChIKey
FSLIIWBFAARILH-UHFFFAOYSA-N
Compound name
6-fluoro-1H-indene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

111
Patents

134.05318 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 135.06046 122.0
[M+Na]+ 157.04240 132.0
[M-H]- 133.04590 125.9
[M+NH4]+ 152.08700 147.1
[M+K]+ 173.01634 129.0
[M+H-H2O]+ 117.05044 116.4
[M+HCOO]- 179.05138 146.4
[M+CH3COO]- 193.06703 137.3
[M+Na-2H]- 155.02785 129.8
[M]+ 134.05263 120.8
[M]- 134.05373 120.8
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