CID 96742784

(1r)-1-(7-fluoro-1-benzofuran-3-yl)ethan-1-amine hydrochloride

Structural Information

Molecular Formula
C10H10FNO
SMILES
C[C@H](C1=COC2=C1C=CC=C2F)N
InChI
InChI=1S/C10H10FNO/c1-6(12)8-5-13-10-7(8)3-2-4-9(10)11/h2-6H,12H2,1H3/t6-/m1/s1
InChIKey
UDFBRQFWZWRZMY-ZCFIWIBFSA-N
Compound name
(1R)-1-(7-fluoro-1-benzofuran-3-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

179.07465 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 180.08193 134.4
[M+Na]+ 202.06387 144.7
[M-H]- 178.06737 138.9
[M+NH4]+ 197.10847 156.0
[M+K]+ 218.03781 142.7
[M+H-H2O]+ 162.07191 128.3
[M+HCOO]- 224.07285 158.4
[M+CH3COO]- 238.08850 183.4
[M+Na-2H]- 200.04932 140.7
[M]+ 179.07410 135.1
[M]- 179.07520 135.1
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.