CID 14513183

124700-26-1

Structural Information

Molecular Formula
C9H7FO
SMILES
C#CCOC1=CC=C(C=C1)F
InChI
InChI=1S/C9H7FO/c1-2-7-11-9-5-3-8(10)4-6-9/h1,3-6H,7H2
InChIKey
KVRJLSPSYFYNAA-UHFFFAOYSA-N
Compound name
1-fluoro-4-prop-2-ynoxybenzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

95
Patents

150.0481 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 151.05538 130.8
[M+Na]+ 173.03732 143.8
[M+NH4]+ 168.08192 135.9
[M+K]+ 189.01126 133.5
[M-H]- 149.04082 123.9
[M+Na-2H]- 171.02277 135.0
[M]+ 150.04755 129.9
[M]- 150.04865 129.9
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