CID 84717309

5,7-difluoro-2-methyl-2,3-dihydro-1h-indole hydrochloride

Structural Information

Molecular Formula
C9H9F2N
SMILES
CC1CC2=C(N1)C(=CC(=C2)F)F
InChI
InChI=1S/C9H9F2N/c1-5-2-6-3-7(10)4-8(11)9(6)12-5/h3-5,12H,2H2,1H3
InChIKey
GBFKTOSIORCILK-UHFFFAOYSA-N
Compound name
5,7-difluoro-2-methyl-2,3-dihydro-1H-indole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

169.07031 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.077586 131.2
[M+Na]+ 192.059528 141.6
[M-H]- 168.063034 131.1
[M+NH4]+ 187.104133 153.3
[M+K]+ 208.033468 137.3
[M+H-H2O]+ 152.067570 124.2
[M+HCOO]- 214.068511 150.1
[M+CH3COO]- 228.084161 177.9
[M+Na-2H]- 190.044976 135.4
[M]+ 169.06976142 126.8
[M]- 169.07085858 126.8
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.