CID 6441804

71735-79-0

Structural Information

Molecular Formula
C15H24O
SMILES
CC1(C/C=C\CC/C=C\CCC2C1(O2)C)C
InChI
InChI=1S/C15H24O/c1-14(2)12-10-8-6-4-5-7-9-11-13-15(14,3)16-13/h5,7-8,10,13H,4,6,9,11-12H2,1-3H3/b7-5-,10-8-
InChIKey
PUXIGTZUWRBNMW-RRMOSLQNSA-N
Compound name
(4Z,8Z)-1,2,2-trimethyl-13-oxabicyclo[10.1.0]trideca-4,8-diene
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

298
Patents

220.18271 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 221.189986 148.2
[M+Na]+ 243.171928 156.3
[M-H]- 219.175434 152.4
[M+NH4]+ 238.216533 163.1
[M+K]+ 259.145868 158.2
[M+H-H2O]+ 203.179970 147.1
[M+HCOO]- 265.180911 165.5
[M+CH3COO]- 279.196561 187.5
[M+Na-2H]- 241.157376 155.2
[M]+ 220.18216142 147.8
[M]- 220.18325858 147.8
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.