CID 16226805

2-(2-methylcyclopropyl)furan

Structural Information

Molecular Formula
C8H10O
SMILES
CC1CC1C2=CC=CO2
InChI
InChI=1S/C8H10O/c1-6-5-7(6)8-3-2-4-9-8/h2-4,6-7H,5H2,1H3
InChIKey
FKLFCFZEGVKNCT-UHFFFAOYSA-N
Compound name
2-(2-methylcyclopropyl)furan
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

5
Patents

122.073166 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 123.08044 120.2
[M+Na]+ 145.06238 130.9
[M-H]- 121.06589 129.0
[M+NH4]+ 140.10699 138.4
[M+K]+ 161.03632 130.2
[M+H-H2O]+ 105.07043 114.7
[M+HCOO]- 167.07137 145.2
[M+CH3COO]- 181.08702 173.8
[M+Na-2H]- 143.04783 127.7
[M]+ 122.07262 124.0
[M]- 122.07371 124.0
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