CID 11658439

6-fluoro-2-(oxiran-2-yl)chroman

Structural Information

Molecular Formula
C11H11FO2
SMILES
C1CC2=C(C=CC(=C2)F)OC1C3CO3
InChI
InChI=1S/C11H11FO2/c12-8-2-4-9-7(5-8)1-3-10(14-9)11-6-13-11/h2,4-5,10-11H,1,3,6H2
InChIKey
GVZDIJGBXSDSEP-UHFFFAOYSA-N
Compound name
6-fluoro-2-(oxiran-2-yl)-3,4-dihydro-2H-chromene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

173
Patents

194.07431 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.08159 137.0
[M+Na]+ 217.06353 147.0
[M-H]- 193.06703 145.4
[M+NH4]+ 212.10813 150.3
[M+K]+ 233.03747 146.5
[M+H-H2O]+ 177.07157 129.1
[M+HCOO]- 239.07251 155.6
[M+CH3COO]- 253.08816 150.4
[M+Na-2H]- 215.04898 145.4
[M]+ 194.07376 138.5
[M]- 194.07486 138.5
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

patents stripe