CID 101215174

(8z)-1,6,10,10-tetramethyl-5,13-dioxatricyclo[10.1.0.04,6]tridec-8-ene

Structural Information

Molecular Formula
C15H24O2
SMILES
CC/1(CC2C(O2)(CCC3C(O3)(C/C=C1)C)C)C
InChI
InChI=1S/C15H24O2/c1-13(2)7-5-8-14(3)11(16-14)6-9-15(4)12(10-13)17-15/h5,7,11-12H,6,8-10H2,1-4H3/b7-5-
InChIKey
UFBUQKAQYQDEOE-ALCCZGGFSA-N
Compound name
(8Z)-1,6,10,10-tetramethyl-5,13-dioxatricyclo[10.1.0.04,6]tridec-8-ene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

236.17763 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 237.18491 159.5
[M+Na]+ 259.16685 167.1
[M-H]- 235.17035 164.9
[M+NH4]+ 254.21145 168.7
[M+K]+ 275.14079 174.0
[M+H-H2O]+ 219.17489 159.6
[M+HCOO]- 281.17583 170.2
[M+CH3COO]- 295.19148 168.9
[M+Na-2H]- 257.15230 165.6
[M]+ 236.17708 164.4
[M]- 236.17818 164.4
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

No patent data available for this compound.