CID 6857792

Avocadenofuran

Structural Information

Molecular Formula
C17H28O
SMILES
C=CCCCCCCCCCCCC1=CC=CO1
InChI
InChI=1S/C17H28O/c1-2-3-4-5-6-7-8-9-10-11-12-14-17-15-13-16-18-17/h2,13,15-16H,1,3-12,14H2
InChIKey
KNKVJBRMGKXDGO-UHFFFAOYSA-N
Compound name
2-tridec-12-enylfuran
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

36
Patents

248.21402 Da
Monoisotopic Mass

7.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 249.22130 165.1
[M+Na]+ 271.20324 175.4
[M+NH4]+ 266.24784 172.7
[M+K]+ 287.17718 168.3
[M-H]- 247.20674 167.8
[M+Na-2H]- 269.18869 168.7
[M]+ 248.21347 167.2
[M]- 248.21457 167.2
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