CID 109415

68480-11-5

Structural Information

Molecular Formula
C13H20O
SMILES
C1CC2C(C1)C3CC2CC34CCCO4
InChI
InChI=1S/C13H20O/c1-3-10-9-7-12(11(10)4-1)13(8-9)5-2-6-14-13/h9-12H,1-8H2
InChIKey
JDJZAKLOMAHING-UHFFFAOYSA-N
Compound name
spiro[oxolane-2,8'-tricyclo[5.2.1.02,6]decane]
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

107
Patents

192.15141 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.15869 145.5
[M+Na]+ 215.14063 152.3
[M+NH4]+ 210.18523 158.1
[M+K]+ 231.11457 151.7
[M-H]- 191.14413 148.6
[M+Na-2H]- 213.12608 146.1
[M]+ 192.15086 147.3
[M]- 192.15196 147.3
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