CID 84764909

2172473-72-0

Structural Information

Molecular Formula
C7H13F2NO
SMILES
CC(C1(CCOCC1)N)(F)F
InChI
InChI=1S/C7H13F2NO/c1-6(8,9)7(10)2-4-11-5-3-7/h2-5,10H2,1H3
InChIKey
BSUNWDBVTSYDIK-UHFFFAOYSA-N
Compound name
4-(1,1-difluoroethyl)oxan-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

165.09653 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.103806 132.9
[M+Na]+ 188.085748 138.7
[M-H]- 164.089254 133.5
[M+NH4]+ 183.130353 153.4
[M+K]+ 204.059688 138.8
[M+H-H2O]+ 148.093790 126.8
[M+HCOO]- 210.094731 149.7
[M+CH3COO]- 224.110381 177.8
[M+Na-2H]- 186.071196 140.0
[M]+ 165.09598142 125.5
[M]- 165.09707858 125.5
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.