CID 25076636

2-methyl-4-(octahydro-4,7-dimethyl-1h-inden-5-yl)cyclohexan-1-ol

Structural Information

Molecular Formula
C18H32O
SMILES
CC1CC(CCC1O)C2CC(C3CCCC3C2C)C
InChI
InChI=1S/C18H32O/c1-11-10-17(13(3)16-6-4-5-15(11)16)14-7-8-18(19)12(2)9-14/h11-19H,4-10H2,1-3H3
InChIKey
ZODCEMZFCDXFQH-UHFFFAOYSA-N
Compound name
4-(4,7-dimethyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-5-yl)-2-methylcyclohexan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

264.24533 Da
Monoisotopic Mass

5.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 265.252606 168.8
[M+Na]+ 287.234548 172.0
[M-H]- 263.238054 173.4
[M+NH4]+ 282.279153 188.0
[M+K]+ 303.208488 167.5
[M+H-H2O]+ 247.242590 162.9
[M+HCOO]- 309.243531 180.8
[M+CH3COO]- 323.259181 199.4
[M+Na-2H]- 285.219996 164.2
[M]+ 264.24478142 160.1
[M]- 264.24587858 160.1
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.