CID 69707

8,8-dimethyl-6,10-dioxaspiro[4.5]decane

Structural Information

Molecular Formula
C10H18O2
SMILES
CC1(COC2(CCCC2)OC1)C
InChI
InChI=1S/C10H18O2/c1-9(2)7-11-10(12-8-9)5-3-4-6-10/h3-8H2,1-2H3
InChIKey
JOXSTTXXTNBJRU-UHFFFAOYSA-N
Compound name
8,8-dimethyl-6,10-dioxaspiro[4.5]decane
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

11
Patents

170.13068 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 171.137956 136.4
[M+Na]+ 193.119898 142.2
[M-H]- 169.123404 142.7
[M+NH4]+ 188.164503 159.9
[M+K]+ 209.093838 143.6
[M+H-H2O]+ 153.127940 132.2
[M+HCOO]- 215.128881 154.1
[M+CH3COO]- 229.144531 175.6
[M+Na-2H]- 191.105346 143.7
[M]+ 170.13013142 133.1
[M]- 170.13122858 133.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe