CID 165590

1,4:5,8-dimethanonaphthalene-2-methanol, 1,2,3,4,4a,5,8,8a-octahydro-

Structural Information

Molecular Formula
C13H18O
SMILES
C1C2CC(C1CO)C3C2C4CC3C=C4
InChI
InChI=1S/C13H18O/c14-6-10-4-9-5-11(10)13-8-2-1-7(3-8)12(9)13/h1-2,7-14H,3-6H2
InChIKey
LLPLOWFYJGZIBV-UHFFFAOYSA-N
Compound name
4-tetracyclo[6.2.1.13,6.02,7]dodec-9-enylmethanol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

226
Patents

190.13577 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.143046 149.1
[M+Na]+ 213.124988 157.1
[M-H]- 189.128494 151.9
[M+NH4]+ 208.169593 179.1
[M+K]+ 229.098928 153.1
[M+H-H2O]+ 173.133030 147.4
[M+HCOO]- 235.133971 167.1
[M+CH3COO]- 249.149621 161.9
[M+Na-2H]- 211.110436 148.6
[M]+ 190.13522142 148.8
[M]- 190.13631858 148.8
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

patents stripe