CID 154577435

2418692-76-7

Structural Information

Molecular Formula
C6H10FNO
SMILES
C1C2(CC1(OC2)CF)N
InChI
InChI=1S/C6H10FNO/c7-3-6-1-5(8,2-6)4-9-6/h1-4,8H2
InChIKey
FJBCJWBMHZGIMH-UHFFFAOYSA-N
Compound name
1-(fluoromethyl)-2-oxabicyclo[2.1.1]hexan-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

131.07465 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 132.08193 129.1
[M+Na]+ 154.06387 136.4
[M-H]- 130.06737 129.8
[M+NH4]+ 149.10847 153.6
[M+K]+ 170.03781 138.1
[M+H-H2O]+ 114.07191 122.6
[M+HCOO]- 176.07285 147.0
[M+CH3COO]- 190.08850 142.5
[M+Na-2H]- 152.04932 139.1
[M]+ 131.07410 139.7
[M]- 131.07520 139.7
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