CID 66922525

6,7-difluoro-2,3-dihydro-1h-inden-1-amine hydrochloride

Structural Information

Molecular Formula
C9H9F2N
SMILES
C1CC2=C(C1N)C(=C(C=C2)F)F
InChI
InChI=1S/C9H9F2N/c10-6-3-1-5-2-4-7(12)8(5)9(6)11/h1,3,7H,2,4,12H2
InChIKey
DAURVHMJENUGCM-UHFFFAOYSA-N
Compound name
6,7-difluoro-2,3-dihydro-1H-inden-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

169.07031 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.07759 130.3
[M+Na]+ 192.05953 140.2
[M-H]- 168.06303 132.5
[M+NH4]+ 187.10413 153.8
[M+K]+ 208.03347 136.5
[M+H-H2O]+ 152.06757 123.7
[M+HCOO]- 214.06851 152.4
[M+CH3COO]- 228.08416 182.0
[M+Na-2H]- 190.04498 134.4
[M]+ 169.06976 125.5
[M]- 169.07086 125.5
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