CID 131074943

2343963-64-2

Structural Information

Molecular Formula
C6H7F2NO
SMILES
C1=COC(=C1)[C@H](C(F)F)N
InChI
InChI=1S/C6H7F2NO/c7-6(8)5(9)4-2-1-3-10-4/h1-3,5-6H,9H2/t5-/m1/s1
InChIKey
MQLXUYBOHLMRFJ-RXMQYKEDSA-N
Compound name
(1R)-2,2-difluoro-1-(furan-2-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

147.04958 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 148.05686 126.6
[M+Na]+ 170.03880 133.8
[M-H]- 146.04230 127.9
[M+NH4]+ 165.08340 147.5
[M+K]+ 186.01274 133.9
[M+H-H2O]+ 130.04684 119.5
[M+HCOO]- 192.04778 148.4
[M+CH3COO]- 206.06343 175.6
[M+Na-2H]- 168.02425 130.6
[M]+ 147.04903 122.7
[M]- 147.05013 122.7
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

No patent data available for this compound.