CID 71356702

Myrcenyl methyl ether

Structural Information

Molecular Formula
C11H20O
SMILES
CC(C)(CCCC(=C)C=C)OC
InChI
InChI=1S/C11H20O/c1-6-10(2)8-7-9-11(3,4)12-5/h6H,1-2,7-9H2,3-5H3
InChIKey
ZOSWMSOQJPTZHW-UHFFFAOYSA-N
Compound name
7-methoxy-7-methyl-3-methylideneoct-1-ene
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

48
Patents

168.15141 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.15869 142.2
[M+Na]+ 191.14063 151.8
[M+NH4]+ 186.18523 149.4
[M+K]+ 207.11457 146.0
[M-H]- 167.14413 140.8
[M+Na-2H]- 189.12608 144.9
[M]+ 168.15086 143.0
[M]- 168.15196 143.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe