CID 28293917

(1s)-6-fluoro-2,3-dihydro-1h-inden-1-ol

Structural Information

Molecular Formula
C9H9FO
SMILES
C1CC2=C([C@H]1O)C=C(C=C2)F
InChI
InChI=1S/C9H9FO/c10-7-3-1-6-2-4-9(11)8(6)5-7/h1,3,5,9,11H,2,4H2/t9-/m0/s1
InChIKey
CLUAHEPQMQFYFJ-VIFPVBQESA-N
Compound name
(1S)-6-fluoro-2,3-dihydro-1H-inden-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

40
Patents

152.06374 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.07102 127.4
[M+Na]+ 175.05296 136.7
[M-H]- 151.05646 129.8
[M+NH4]+ 170.09756 151.2
[M+K]+ 191.02690 133.5
[M+H-H2O]+ 135.06100 122.1
[M+HCOO]- 197.06194 148.9
[M+CH3COO]- 211.07759 173.4
[M+Na-2H]- 173.03841 133.0
[M]+ 152.06319 124.7
[M]- 152.06429 124.7
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