CID 438365

Nsc633610

Structural Information

Molecular Formula
C14H20
SMILES
C1CCC2=C3CCCCCC3=C2CC1
InChI
InChI=1S/C14H20/c1-3-7-11-12(8-4-1)14-10-6-2-5-9-13(11)14/h1-10H2
InChIKey
BWCZGKFZLAQUPX-UHFFFAOYSA-N
Compound name
tricyclo[7.5.0.02,8]tetradeca-1,8-diene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

188.1565 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 189.16378 146.3
[M+Na]+ 211.14572 151.4
[M-H]- 187.14922 153.4
[M+NH4]+ 206.19032 159.3
[M+K]+ 227.11966 151.2
[M+H-H2O]+ 171.15376 143.0
[M+HCOO]- 233.15470 161.2
[M+CH3COO]- 247.17035 156.3
[M+Na-2H]- 209.13117 151.1
[M]+ 188.15595 146.0
[M]- 188.15705 146.0
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.