CID 109415

Decahydrospiro[furan-2(3h),5'-[4,7]methano[5h]indene]

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
3
Annotation Hits

0
References

125
Patents

192.15141 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.158686 150.1
[M+Na]+ 215.140628 156.4
[M-H]- 191.144134 156.4
[M+NH4]+ 210.185233 179.5
[M+K]+ 231.114568 154.2
[M+H-H2O]+ 175.148670 147.5
[M+HCOO]- 237.149611 167.7
[M+CH3COO]- 251.165261 162.9
[M+Na-2H]- 213.126076 149.7
[M]+ 192.15086142 146.4
[M]- 192.15195858 146.4
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