CID 121553066

1909327-49-6

Structural Information

Molecular Formula
C10H11ClFN
SMILES
C1CC(C2=C(C1)C(=CC(=C2)Cl)F)N
InChI
InChI=1S/C10H11ClFN/c11-6-4-8-7(9(12)5-6)2-1-3-10(8)13/h4-5,10H,1-3,13H2
InChIKey
YIXVWVJASOXRJT-UHFFFAOYSA-N
Compound name
7-chloro-5-fluoro-1,2,3,4-tetrahydronaphthalen-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

199.05641 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 200.06369 139.0
[M+Na]+ 222.04563 148.3
[M-H]- 198.04913 141.7
[M+NH4]+ 217.09023 160.2
[M+K]+ 238.01957 142.9
[M+H-H2O]+ 182.05367 133.5
[M+HCOO]- 244.05461 155.0
[M+CH3COO]- 258.07026 186.5
[M+Na-2H]- 220.03108 144.0
[M]+ 199.05586 135.6
[M]- 199.05696 135.6
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.