CID 11159354

Exo-tetrahydrodicyclopentadiene

Structural Information

Molecular Formula
C10H16
SMILES
C1C[C@H]2[C@@H]3CC[C@@H](C3)[C@H]2C1
InChI
InChI=1S/C10H16/c1-2-9-7-4-5-8(6-7)10(9)3-1/h7-10H,1-6H2/t7-,8+,9+,10-
InChIKey
LPSXSORODABQKT-FIRGSJFUSA-N
Compound name
(1S,2R,6S,7R)-tricyclo[5.2.1.02,6]decane
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

8
References

9510
Patents

136.1252 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 137.13248 134.6
[M+Na]+ 159.11442 141.3
[M-H]- 135.11792 138.2
[M+NH4]+ 154.15902 164.0
[M+K]+ 175.08836 139.0
[M+H-H2O]+ 119.12246 131.0
[M+HCOO]- 181.12340 154.7
[M+CH3COO]- 195.13905 148.2
[M+Na-2H]- 157.09987 136.5
[M]+ 136.12465 131.3
[M]- 136.12575 131.3
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.