CID 16228765

2-fluoro-1-(naphthalen-1-yl)ethan-1-aminehydrochloride

Structural Information

Molecular Formula
C12H12FN
SMILES
C1=CC=C2C(=C1)C=CC=C2C(CF)N
InChI
InChI=1S/C12H12FN/c13-8-12(14)11-7-3-5-9-4-1-2-6-10(9)11/h1-7,12H,8,14H2
InChIKey
BKSFMRCTZMLCGE-UHFFFAOYSA-N
Compound name
2-fluoro-1-naphthalen-1-ylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

189.09538 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.10266 138.9
[M+Na]+ 212.08460 146.4
[M-H]- 188.08810 141.6
[M+NH4]+ 207.12920 159.1
[M+K]+ 228.05854 142.5
[M+H-H2O]+ 172.09264 131.9
[M+HCOO]- 234.09358 160.8
[M+CH3COO]- 248.10923 186.6
[M+Na-2H]- 210.07005 145.6
[M]+ 189.09483 135.6
[M]- 189.09593 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

patents stripe