CID 44147517

Octahydro-8-methoxy-1,1,5,5-tetramethyl-2h-2,4a-methanonaphthalene

Structural Information

Molecular Formula
C16H28O
SMILES
CC1(CCC(C2C13CCC(C3)C2(C)C)OC)C
InChI
InChI=1S/C16H28O/c1-14(2)8-7-12(17-5)13-15(3,4)11-6-9-16(13,14)10-11/h11-13H,6-10H2,1-5H3
InChIKey
CAASAEIMOLBQBR-UHFFFAOYSA-N
Compound name
10-methoxy-2,2,8,8-tetramethyl-octahydro-1H-2,4a-methanonapthalene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

236.21402 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 237.221296 158.1
[M+Na]+ 259.203238 166.0
[M-H]- 235.206744 162.4
[M+NH4]+ 254.247843 188.0
[M+K]+ 275.177178 162.0
[M+H-H2O]+ 219.211280 154.5
[M+HCOO]- 281.212221 174.3
[M+CH3COO]- 295.227871 195.2
[M+Na-2H]- 257.188686 160.4
[M]+ 236.21347142 157.6
[M]- 236.21456858 157.6
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

No patent data available for this compound.