CID 146082096

6,6,9,9-tetramethyl-1,4-dioxaspiro[4.5]decan-7-one

Structural Information

Molecular Formula
C12H20O3
SMILES
CC1(CC(=O)C(C2(C1)OCCO2)(C)C)C
InChI
InChI=1S/C12H20O3/c1-10(2)7-9(13)11(3,4)12(8-10)14-5-6-15-12/h5-8H2,1-4H3
InChIKey
ZWHMIFVMZUZJAU-UHFFFAOYSA-N
Compound name
6,6,9,9-tetramethyl-1,4-dioxaspiro[4.5]decan-7-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

212.14125 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.14853 145.0
[M+Na]+ 235.13047 155.0
[M+NH4]+ 230.17507 157.5
[M+K]+ 251.10441 146.8
[M-H]- 211.13397 149.6
[M+Na-2H]- 233.11592 152.1
[M]+ 212.14070 148.1
[M]- 212.14180 148.1
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.