CID 12762300

2-decylfuran

Structural Information

Molecular Formula
C14H24O
SMILES
CCCCCCCCCCC1=CC=CO1
InChI
InChI=1S/C14H24O/c1-2-3-4-5-6-7-8-9-11-14-12-10-13-15-14/h10,12-13H,2-9,11H2,1H3
InChIKey
PIBKIYYQPWSUDP-UHFFFAOYSA-N
Compound name
2-decylfuran
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

0
References

63
Patents

208.18271 Da
Monoisotopic Mass

6.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.18999 153.2
[M+Na]+ 231.17193 158.4
[M-H]- 207.17543 156.2
[M+NH4]+ 226.21653 172.7
[M+K]+ 247.14587 156.9
[M+H-H2O]+ 191.17997 147.0
[M+HCOO]- 253.18091 176.0
[M+CH3COO]- 267.19656 188.6
[M+Na-2H]- 229.15738 157.3
[M]+ 208.18216 157.6
[M]- 208.18326 157.6
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