CID 63898288

1-(trifluoromethyl)-2,3-dihydro-1h-inden-1-amine hydrochloride

Structural Information

Molecular Formula
C10H10F3N
SMILES
C1CC(C2=CC=CC=C21)(C(F)(F)F)N
InChI
InChI=1S/C10H10F3N/c11-10(12,13)9(14)6-5-7-3-1-2-4-8(7)9/h1-4H,5-6,14H2
InChIKey
BVHDBTDFAYSBCV-UHFFFAOYSA-N
Compound name
1-(trifluoromethyl)-2,3-dihydroinden-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

201.07654 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.083816 138.9
[M+Na]+ 224.065758 148.1
[M-H]- 200.069264 139.5
[M+NH4]+ 219.110363 162.6
[M+K]+ 240.039698 144.2
[M+H-H2O]+ 184.073800 132.0
[M+HCOO]- 246.074741 158.1
[M+CH3COO]- 260.090391 184.8
[M+Na-2H]- 222.051206 145.1
[M]+ 201.07599142 132.3
[M]- 201.07708858 132.3
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