CID 108809

59691-23-5

Structural Information

Molecular Formula
C11H14O
SMILES
C1C=C[C@@H]2[C@H]1[C@@H]3C[C@H]([C@H]2C3)C=O
InChI
InChI=1S/C11H14O/c12-6-8-4-7-5-11(8)10-3-1-2-9(7)10/h1,3,6-11H,2,4-5H2/t7-,8+,9-,10-,11-/m1/s1
InChIKey
MOIHSCPKBNWGRI-RCZSTQMZSA-N
Compound name
(1S,2R,6R,7S,8R)-tricyclo[5.2.1.02,6]dec-4-ene-8-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

162.10446 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 163.11174 135.5
[M+Na]+ 185.09368 144.4
[M+NH4]+ 180.13828 146.1
[M+K]+ 201.06762 143.2
[M-H]- 161.09718 136.5
[M+Na-2H]- 183.07913 136.4
[M]+ 162.10391 136.8
[M]- 162.10501 136.8
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.