CID 347423

7534-77-2

Structural Information

Molecular Formula
C13H18O
SMILES
C=CCOC1CC2CC1C3C2C=CC3
InChI
InChI=1S/C13H18O/c1-2-6-14-13-8-9-7-12(13)11-5-3-4-10(9)11/h2-4,9-13H,1,5-8H2
InChIKey
CJBBUKCSNYALMD-UHFFFAOYSA-N
Compound name
8-prop-2-enoxytricyclo[5.2.1.02,6]dec-3-ene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

190.13577 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.14305 144.4
[M+Na]+ 213.12499 152.9
[M+NH4]+ 208.16959 154.7
[M+K]+ 229.09893 151.2
[M-H]- 189.12849 145.3
[M+Na-2H]- 211.11044 144.7
[M]+ 190.13522 145.6
[M]- 190.13632 145.6
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

No patent data available for this compound.