CID 637342

1-fluoro-4-(prop-2-en-1-yloxy)benzene

Structural Information

Molecular Formula
C9H9FO
SMILES
C=CCOC1=CC=C(C=C1)F
InChI
InChI=1S/C9H9FO/c1-2-7-11-9-5-3-8(10)4-6-9/h2-6H,1,7H2
InChIKey
ZBUDNSQUWYPTSR-UHFFFAOYSA-N
Compound name
1-fluoro-4-prop-2-enoxybenzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

191
Patents

152.06374 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.07102 127.5
[M+Na]+ 175.05296 136.3
[M-H]- 151.05646 130.1
[M+NH4]+ 170.09756 148.9
[M+K]+ 191.02690 134.0
[M+H-H2O]+ 135.06100 121.3
[M+HCOO]- 197.06194 151.6
[M+CH3COO]- 211.07759 176.4
[M+Na-2H]- 173.03841 134.7
[M]+ 152.06319 127.5
[M]- 152.06429 127.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe