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]+ 148.056856 126.6
[M+Na]+ 170.038798 133.8
[M-H]- 146.042304 127.9
[M+NH4]+ 165.083403 147.5
[M+K]+ 186.012738 133.9
[M+H-H2O]+ 130.046840 119.5
[M+HCOO]- 192.047781 148.4
[M+CH3COO]- 206.063431 175.6
[M+Na-2H]- 168.024246 130.6
[M]+ 147.04903142 122.7
[M]- 147.05012858 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.