CID 15613616

2-ethyl-7-methyl-1,6-dioxaspiro[4.5]decane

Structural Information

Molecular Formula
C11H20O2
SMILES
CCC1CCC2(O1)CCCC(O2)C
InChI
InChI=1S/C11H20O2/c1-3-10-6-8-11(13-10)7-4-5-9(2)12-11/h9-10H,3-8H2,1-2H3
InChIKey
QPZCAIDDTOIXQQ-UHFFFAOYSA-N
Compound name
2-ethyl-9-methyl-1,10-dioxaspiro[4.5]decane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

184.14633 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.15361 141.8
[M+Na]+ 207.13555 147.2
[M-H]- 183.13905 147.9
[M+NH4]+ 202.18015 163.1
[M+K]+ 223.10949 148.0
[M+H-H2O]+ 167.14359 137.0
[M+HCOO]- 229.14453 159.2
[M+CH3COO]- 243.16018 179.9
[M+Na-2H]- 205.12100 146.8
[M]+ 184.14578 138.9
[M]- 184.14688 138.9
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