CID 44152350

94278-44-1

Structural Information

Molecular Formula
C14H26O
SMILES
CC1CC2(CCC(CC2)C(C)(C)C)OC1
InChI
InChI=1S/C14H26O/c1-11-9-14(15-10-11)7-5-12(6-8-14)13(2,3)4/h11-12H,5-10H2,1-4H3
InChIKey
FHNJABUFDVGIFH-UHFFFAOYSA-N
Compound name
8-tert-butyl-3-methyl-1-oxaspiro[4.5]decane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

210.19836 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.205636 151.8
[M+Na]+ 233.187578 156.5
[M-H]- 209.191084 157.2
[M+NH4]+ 228.232183 173.7
[M+K]+ 249.161518 155.7
[M+H-H2O]+ 193.195620 147.3
[M+HCOO]- 255.196561 167.5
[M+CH3COO]- 269.212211 186.5
[M+Na-2H]- 231.173026 155.3
[M]+ 210.19781142 147.4
[M]- 210.19890858 147.4
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.