CID 117476

2-methoxyfuran

Structural Information

Molecular Formula
C5H6O2
SMILES
COC1=CC=CO1
InChI
InChI=1S/C5H6O2/c1-6-5-3-2-4-7-5/h2-4H,1H3
InChIKey
OXCGHDNCMSOEBZ-UHFFFAOYSA-N
Compound name
2-methoxyfuran
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

8
References

1083
Patents

98.03678 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 99.044056 113.3
[M+Na]+ 121.02600 122.4
[M-H]- 97.029504 118.1
[M+NH4]+ 116.07060 137.2
[M+K]+ 136.99994 123.8
[M+H-H2O]+ 81.034040 108.9
[M+HCOO]- 143.03498 139.5
[M+CH3COO]- 157.05063 163.3
[M+Na-2H]- 119.01145 122.6
[M]+ 98.036231 116.0
[M]- 98.037329 116.0
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