CID 79119361

5-(2-methoxyethoxy)furan-2-carbaldehyde

Structural Information

Molecular Formula
C8H10O4
SMILES
COCCOC1=CC=C(O1)C=O
InChI
InChI=1S/C8H10O4/c1-10-4-5-11-8-3-2-7(6-9)12-8/h2-3,6H,4-5H2,1H3
InChIKey
ZYBYBBJRZRCVPK-UHFFFAOYSA-N
Compound name
5-(2-methoxyethoxy)furan-2-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

170.0579 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 171.065176 131.5
[M+Na]+ 193.047118 140.4
[M-H]- 169.050624 136.1
[M+NH4]+ 188.091723 152.6
[M+K]+ 209.021058 141.3
[M+H-H2O]+ 153.055160 126.4
[M+HCOO]- 215.056101 157.3
[M+CH3COO]- 229.071751 176.7
[M+Na-2H]- 191.032566 138.5
[M]+ 170.05735142 137.9
[M]- 170.05844858 137.9
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

No patent data available for this compound.