CID 61697694

1-[(1-aminobutan-2-yl)oxy]-2-fluorobenzene

Structural Information

Molecular Formula
C10H14FNO
SMILES
CCC(CN)OC1=CC=CC=C1F
InChI
InChI=1S/C10H14FNO/c1-2-8(7-12)13-10-6-4-3-5-9(10)11/h3-6,8H,2,7,12H2,1H3
InChIKey
QVAGGNDTYUYINE-UHFFFAOYSA-N
Compound name
2-(2-fluorophenoxy)butan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

183.10594 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.11322 139.2
[M+Na]+ 206.09516 146.0
[M-H]- 182.09866 141.0
[M+NH4]+ 201.13976 158.7
[M+K]+ 222.06910 144.0
[M+H-H2O]+ 166.10320 132.2
[M+HCOO]- 228.10414 162.0
[M+CH3COO]- 242.11979 185.2
[M+Na-2H]- 204.08061 143.5
[M]+ 183.10539 137.8
[M]- 183.10649 137.8
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.