CID 171035438

6-methyl-2,5-dioxa-8-azaspiro[3.5]nonane

Structural Information

Molecular Formula
C7H13NO2
SMILES
CC1CNCC2(O1)COC2
InChI
InChI=1S/C7H13NO2/c1-6-2-8-3-7(10-6)4-9-5-7/h6,8H,2-5H2,1H3
InChIKey
XJXJWORRWVBMPG-UHFFFAOYSA-N
Compound name
6-methyl-2,5-dioxa-8-azaspiro[3.5]nonane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

143.09464 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.101916 122.5
[M+Na]+ 166.083858 127.3
[M-H]- 142.087364 126.3
[M+NH4]+ 161.128463 135.1
[M+K]+ 182.057798 131.7
[M+H-H2O]+ 126.091900 112.5
[M+HCOO]- 188.092841 137.7
[M+CH3COO]- 202.108491 172.4
[M+Na-2H]- 164.069306 131.8
[M]+ 143.09409142 127.2
[M]- 143.09518858 127.2
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.