CID 70972

Furan, 2,2'-methylenebis-

Structural Information

Molecular Formula
C9H8O2
SMILES
C1=COC(=C1)CC2=CC=CO2
InChI
InChI=1S/C9H8O2/c1-3-8(10-5-1)7-9-4-2-6-11-9/h1-6H,7H2
InChIKey
YHGNXEIQSHICNK-UHFFFAOYSA-N
Compound name
2-(furan-2-ylmethyl)furan
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

2
References

404
Patents

148.05243 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 149.05971 125.3
[M+Na]+ 171.04165 135.1
[M-H]- 147.04515 134.0
[M+NH4]+ 166.08625 147.4
[M+K]+ 187.01559 135.8
[M+H-H2O]+ 131.04969 120.7
[M+HCOO]- 193.05063 152.8
[M+CH3COO]- 207.06628 141.7
[M+Na-2H]- 169.02710 133.8
[M]+ 148.05188 129.7
[M]- 148.05298 129.7
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