CID 6453764

Octahydro-7a,8,8-trimethyl-1,5-methano-1h-inden-1-ol

Structural Information

Molecular Formula
C13H22O
SMILES
CC1(C2CCC3(C1(CCC3C2)O)C)C
InChI
InChI=1S/C13H22O/c1-11(2)9-4-6-12(3)10(8-9)5-7-13(11,12)14/h9-10,14H,4-8H2,1-3H3
InChIKey
CMXNZZUTVVYBLJ-UHFFFAOYSA-N
Compound name
2,2,7-trimethyltricyclo[4.3.1.03,7]decan-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

194.16707 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.17435 146.9
[M+Na]+ 217.15629 153.6
[M-H]- 193.15979 145.2
[M+NH4]+ 212.20089 178.2
[M+K]+ 233.13023 148.9
[M+H-H2O]+ 177.16433 142.2
[M+HCOO]- 239.16527 156.6
[M+CH3COO]- 253.18092 158.0
[M+Na-2H]- 215.14174 155.6
[M]+ 194.16652 146.8
[M]- 194.16762 146.8
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