CID 77907

2-propylfuran

Structural Information

Molecular Formula
C7H10O
SMILES
CCCC1=CC=CO1
InChI
InChI=1S/C7H10O/c1-2-4-7-5-3-6-8-7/h3,5-6H,2,4H2,1H3
InChIKey
CPLJMYOQYRCCBY-UHFFFAOYSA-N
Compound name
2-propylfuran
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

2
References

1752
Patents

110.073166 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 111.08044 120.1
[M+Na]+ 133.06238 132.5
[M+NH4]+ 128.10699 129.8
[M+K]+ 149.03632 127.9
[M-H]- 109.06589 123.6
[M+Na-2H]- 131.04783 126.7
[M]+ 110.07262 122.9
[M]- 110.07371 122.9
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