CID 6451691

Decahydro-2,5,5-trimethyl-2-naphthol

Structural Information

Molecular Formula
C13H24O
SMILES
CC1(CCCC2C1CCC(C2)(C)O)C
InChI
InChI=1S/C13H24O/c1-12(2)7-4-5-10-9-13(3,14)8-6-11(10)12/h10-11,14H,4-9H2,1-3H3
InChIKey
ZQNQUNNLSOTEJY-UHFFFAOYSA-N
Compound name
2,5,5-trimethyl-1,3,4,4a,6,7,8,8a-octahydronaphthalen-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

347
Patents

196.18271 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 197.18999 148.1
[M+Na]+ 219.17193 158.6
[M+NH4]+ 214.21653 160.7
[M+K]+ 235.14587 147.9
[M-H]- 195.17543 150.8
[M+Na-2H]- 217.15738 154.4
[M]+ 196.18216 150.6
[M]- 196.18326 150.6
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