CID 78936069

2702045-48-3

Structural Information

Molecular Formula
C8H10FNO
SMILES
C[C@H](C1=C(C=C(C=C1)F)O)N
InChI
InChI=1S/C8H10FNO/c1-5(10)7-3-2-6(9)4-8(7)11/h2-5,11H,10H2,1H3/t5-/m1/s1
InChIKey
UOYQFEYBPZGEAZ-RXMQYKEDSA-N
Compound name
2-[(1R)-1-aminoethyl]-5-fluorophenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

155.07465 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.08193 130.0
[M+Na]+ 178.06387 138.3
[M-H]- 154.06737 131.2
[M+NH4]+ 173.10847 150.3
[M+K]+ 194.03781 135.9
[M+H-H2O]+ 138.07191 124.0
[M+HCOO]- 200.07285 152.0
[M+CH3COO]- 214.08850 177.7
[M+Na-2H]- 176.04932 134.2
[M]+ 155.07410 126.3
[M]- 155.07520 126.3
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

No patent data available for this compound.