CID 84768946

(5,7-difluoro-2,3-dihydro-1h-inden-1-yl)methanamine

Structural Information

Molecular Formula
C10H11F2N
SMILES
C1CC2=C(C1CN)C(=CC(=C2)F)F
InChI
InChI=1S/C10H11F2N/c11-8-3-6-1-2-7(5-13)10(6)9(12)4-8/h3-4,7H,1-2,5,13H2
InChIKey
SCYVBKIKEODEHK-UHFFFAOYSA-N
Compound name
(5,7-difluoro-2,3-dihydro-1H-inden-1-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

183.08595 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.093226 135.1
[M+Na]+ 206.075168 144.6
[M-H]- 182.078674 137.0
[M+NH4]+ 201.119773 158.0
[M+K]+ 222.049108 140.6
[M+H-H2O]+ 166.083210 128.3
[M+HCOO]- 228.084151 156.9
[M+CH3COO]- 242.099801 185.0
[M+Na-2H]- 204.060616 138.6
[M]+ 183.08540142 130.6
[M]- 183.08649858 130.6
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.