CID 18414069

6-fluoro-3,4-dihydro-2h-1-benzopyran-8-amine

Structural Information

Molecular Formula
C9H10FNO
SMILES
C1CC2=C(C(=CC(=C2)F)N)OC1
InChI
InChI=1S/C9H10FNO/c10-7-4-6-2-1-3-12-9(6)8(11)5-7/h4-5H,1-3,11H2
InChIKey
AEICTTXLAITIQJ-UHFFFAOYSA-N
Compound name
6-fluoro-3,4-dihydro-2H-chromen-8-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

19
Patents

167.07465 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.08193 131.4
[M+Na]+ 190.06387 139.4
[M-H]- 166.06737 134.9
[M+NH4]+ 185.10847 151.4
[M+K]+ 206.03781 137.7
[M+H-H2O]+ 150.07191 124.8
[M+HCOO]- 212.07285 151.6
[M+CH3COO]- 226.08850 180.5
[M+Na-2H]- 188.04932 139.1
[M]+ 167.07410 127.2
[M]- 167.07520 127.2
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