CID 55275887

2377004-23-2

Structural Information

Molecular Formula
C10H11F2NO
SMILES
C1CC2=C([C@@H]1N)C=C(C=C2)OC(F)F
InChI
InChI=1S/C10H11F2NO/c11-10(12)14-7-3-1-6-2-4-9(13)8(6)5-7/h1,3,5,9-10H,2,4,13H2/t9-/m1/s1
InChIKey
HSESMZJIQAZLAC-SECBINFHSA-N
Compound name
(1R)-6-(difluoromethoxy)-2,3-dihydro-1H-inden-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

199.08087 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 200.088146 139.1
[M+Na]+ 222.070088 147.2
[M-H]- 198.073594 140.7
[M+NH4]+ 217.114693 160.8
[M+K]+ 238.044028 144.2
[M+H-H2O]+ 182.078130 131.9
[M+HCOO]- 244.079071 160.0
[M+CH3COO]- 258.094721 186.8
[M+Na-2H]- 220.055536 142.0
[M]+ 199.08032142 135.0
[M]- 199.08141858 135.0
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.