CID 58742071

1-fluoro-4-(2-methoxyethoxy)benzene

Structural Information

Molecular Formula
C9H11FO2
SMILES
COCCOC1=CC=C(C=C1)F
InChI
InChI=1S/C9H11FO2/c1-11-6-7-12-9-4-2-8(10)3-5-9/h2-5H,6-7H2,1H3
InChIKey
RBTCKTFQFSZUQX-UHFFFAOYSA-N
Compound name
1-fluoro-4-(2-methoxyethoxy)benzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

40
Patents

170.07431 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 171.08159 132.3
[M+Na]+ 193.06353 140.7
[M-H]- 169.06703 134.9
[M+NH4]+ 188.10813 153.0
[M+K]+ 209.03747 139.5
[M+H-H2O]+ 153.07157 125.8
[M+HCOO]- 215.07251 156.4
[M+CH3COO]- 229.08816 179.2
[M+Na-2H]- 191.04898 139.4
[M]+ 170.07376 134.4
[M]- 170.07486 134.4
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