CID 19838536

17-oxabicyclo[14.1.0]heptadec-8-ene

Structural Information

Molecular Formula
C16H28O
SMILES
C1CCCC2C(O2)CCCCCC/C=C\CC1
InChI
InChI=1S/C16H28O/c1-2-4-6-8-10-12-14-16-15(17-16)13-11-9-7-5-3-1/h1-2,15-16H,3-14H2/b2-1-
InChIKey
QJDXLECULVHLTA-UPHRSURJSA-N
Compound name
(8Z)-17-oxabicyclo[14.1.0]heptadec-8-ene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
Patents

236.21402 Da
Monoisotopic Mass

5.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 237.22130 152.2
[M+Na]+ 259.20324 163.8
[M+NH4]+ 254.24784 161.5
[M+K]+ 275.17718 157.8
[M-H]- 235.20674 164.3
[M+Na-2H]- 257.18869 160.3
[M]+ 236.21347 158.0
[M]- 236.21457 158.0
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