CID 95184

6316-16-1

Structural Information

Molecular Formula
C10H12O
SMILES
C1C=CC2C1C3CC2C(=O)C3
InChI
InChI=1S/C10H12O/c11-10-5-6-4-9(10)8-3-1-2-7(6)8/h1,3,6-9H,2,4-5H2
InChIKey
UCWKJFXRPXCVCD-UHFFFAOYSA-N
Compound name
tricyclo[5.2.1.02,6]dec-4-en-8-one
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

27
Patents

148.08882 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 149.096096 134.1
[M+Na]+ 171.078038 142.9
[M-H]- 147.081544 138.5
[M+NH4]+ 166.122643 163.4
[M+K]+ 187.051978 140.3
[M+H-H2O]+ 131.086080 131.0
[M+HCOO]- 193.087021 156.1
[M+CH3COO]- 207.102671 148.7
[M+Na-2H]- 169.063486 136.6
[M]+ 148.08827142 133.4
[M]- 148.08936858 133.4
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