CID 7022245

5-(phenoxymethyl)furan-2-carbaldehyde

Structural Information

Molecular Formula
C12H10O3
SMILES
C1=CC=C(C=C1)OCC2=CC=C(O2)C=O
InChI
InChI=1S/C12H10O3/c13-8-11-6-7-12(15-11)9-14-10-4-2-1-3-5-10/h1-8H,9H2
InChIKey
UEFQGYJMYZTWIJ-UHFFFAOYSA-N
Compound name
5-(phenoxymethyl)furan-2-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

202.06299 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 203.07027 141.8
[M+Na]+ 225.05221 155.6
[M+NH4]+ 220.09681 150.4
[M+K]+ 241.02615 150.6
[M-H]- 201.05571 146.7
[M+Na-2H]- 223.03766 150.0
[M]+ 202.06244 145.2
[M]- 202.06354 145.2
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