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]+ 170.07759 131.2
[M+Na]+ 192.05953 141.6
[M-H]- 168.06303 131.1
[M+NH4]+ 187.10413 153.3
[M+K]+ 208.03347 137.3
[M+H-H2O]+ 152.06757 124.2
[M+HCOO]- 214.06851 150.1
[M+CH3COO]- 228.08416 177.9
[M+Na-2H]- 190.04498 135.4
[M]+ 169.06976 126.8
[M]- 169.07086 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.