CID 25082929

Octahydro-1,1,3-trimethyl-1h-inden-5-ol

Structural Information

Molecular Formula
C12H22O
SMILES
CC1CC(C2C1CC(CC2)O)(C)C
InChI
InChI=1S/C12H22O/c1-8-7-12(2,3)11-5-4-9(13)6-10(8)11/h8-11,13H,4-7H2,1-3H3
InChIKey
KROBFAVVQSFTEU-UHFFFAOYSA-N
Compound name
1,1,3-trimethyl-2,3,3a,4,5,6,7,7a-octahydroinden-5-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

182.16707 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.174346 143.4
[M+Na]+ 205.156288 150.2
[M-H]- 181.159794 146.3
[M+NH4]+ 200.200893 168.2
[M+K]+ 221.130228 147.3
[M+H-H2O]+ 165.164330 139.6
[M+HCOO]- 227.165271 160.5
[M+CH3COO]- 241.180921 181.6
[M+Na-2H]- 203.141736 145.4
[M]+ 182.16652142 139.1
[M]- 182.16761858 139.1
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.