CID 101926

2,3-dimethyl-1,4-dioxaspiro[4.11]hexadecane

Structural Information

Molecular Formula
C16H30O2
SMILES
CC1C(OC2(O1)CCCCCCCCCCC2)C
InChI
InChI=1S/C16H30O2/c1-14-15(2)18-16(17-14)12-10-8-6-4-3-5-7-9-11-13-16/h14-15H,3-13H2,1-2H3
InChIKey
WNWSBQSNVBSDST-UHFFFAOYSA-N
Compound name
2,3-dimethyl-1,4-dioxaspiro[4.11]hexadecane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

254.22458 Da
Monoisotopic Mass

5.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 255.23186 162.7
[M+Na]+ 277.21380 171.3
[M+NH4]+ 272.25840 172.0
[M+K]+ 293.18774 165.0
[M-H]- 253.21730 168.6
[M+Na-2H]- 275.19925 166.8
[M]+ 254.22403 165.3
[M]- 254.22513 165.3
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.