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
2
Annotation Hits

0
References

43
Patents

148.08882 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 149.09610 134.1
[M+Na]+ 171.07804 142.9
[M-H]- 147.08154 138.5
[M+NH4]+ 166.12264 163.4
[M+K]+ 187.05198 140.3
[M+H-H2O]+ 131.08608 131.0
[M+HCOO]- 193.08702 156.1
[M+CH3COO]- 207.10267 148.7
[M+Na-2H]- 169.06349 136.6
[M]+ 148.08827 133.4
[M]- 148.08937 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