CID 58046455

1909288-26-1

Structural Information

Molecular Formula
C6H11F2NO
SMILES
C1C[C@H]([C@@H](C(C1)(F)F)O)N
InChI
InChI=1S/C6H11F2NO/c7-6(8)3-1-2-4(9)5(6)10/h4-5,10H,1-3,9H2/t4-,5+/m1/s1
InChIKey
YELVGYMNGIHCKI-UHNVWZDZSA-N
Compound name
cis-(1S,6R)-6-amino-2,2-difluorocyclohexan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

73
Patents

151.08087 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.088146 128.2
[M+Na]+ 174.070088 135.4
[M-H]- 150.073594 127.5
[M+NH4]+ 169.114693 150.4
[M+K]+ 190.044028 133.5
[M+H-H2O]+ 134.078130 122.5
[M+HCOO]- 196.079071 146.3
[M+CH3COO]- 210.094721 174.2
[M+Na-2H]- 172.055536 132.3
[M]+ 151.08032142 119.2
[M]- 151.08141858 119.2
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