CID 97048169

Rel-(2s,3r)-2-(3,4-difluorophenyl)oxolan-3-amine

Structural Information

Molecular Formula
C10H11F2NO
SMILES
C1CO[C@H]([C@@H]1N)C2=CC(=C(C=C2)F)F
InChI
InChI=1S/C10H11F2NO/c11-7-2-1-6(5-8(7)12)10-9(13)3-4-14-10/h1-2,5,9-10H,3-4,13H2/t9-,10+/m1/s1
InChIKey
HZGZIFLIEJLQJI-ZJUUUORDSA-N
Compound name
(2S,3R)-2-(3,4-difluorophenyl)oxolan-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

199.08087 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 200.08815 144.5
[M+Na]+ 222.07009 154.6
[M+NH4]+ 217.11469 152.1
[M+K]+ 238.04403 150.5
[M-H]- 198.07359 147.0
[M+Na-2H]- 220.05554 149.2
[M]+ 199.08032 146.4
[M]- 199.08142 146.4
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

No patent data available for this compound.