CID 56843723

Einecs 298-069-7

Structural Information

Molecular Formula
C14H20O
SMILES
CC1CC2(CC3CC2C4C3CC=C4)OC1
InChI
InChI=1S/C14H20O/c1-9-6-14(15-8-9)7-10-5-13(14)12-4-2-3-11(10)12/h2,4,9-13H,3,5-8H2,1H3
InChIKey
FVPHLRMMPMJDSO-UHFFFAOYSA-N
Compound name
4-methylspiro[oxolane-2,9'-tricyclo[5.2.1.02,6]dec-3-ene]
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

204.15141 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.15869 152.4
[M+Na]+ 227.14063 160.2
[M-H]- 203.14413 159.3
[M+NH4]+ 222.18523 181.8
[M+K]+ 243.11457 157.5
[M+H-H2O]+ 187.14867 150.1
[M+HCOO]- 249.14961 171.1
[M+CH3COO]- 263.16526 165.7
[M+Na-2H]- 225.12608 152.0
[M]+ 204.15086 150.9
[M]- 204.15196 150.9
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.