CID 56843657

26244-01-9

Structural Information

Molecular Formula
C14H20O
SMILES
C1CC2C(C1)C3CC2CC34CCC=CO4
InChI
InChI=1S/C14H20O/c1-2-7-15-14(6-1)9-10-8-13(14)12-5-3-4-11(10)12/h2,7,10-13H,1,3-6,8-9H2
InChIKey
ARDSHAQGJRDFIU-UHFFFAOYSA-N
Compound name
spiro[3,4-dihydropyran-2,8'-tricyclo[5.2.1.02,6]decane]
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

204.15141 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.15869 149.8
[M+Na]+ 227.14063 155.9
[M-H]- 203.14413 155.7
[M+NH4]+ 222.18523 177.3
[M+K]+ 243.11457 153.0
[M+H-H2O]+ 187.14867 145.8
[M+HCOO]- 249.14961 166.4
[M+CH3COO]- 263.16526 162.2
[M+Na-2H]- 225.12608 151.4
[M]+ 204.15086 145.5
[M]- 204.15196 145.5
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.