CID 154577348

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

Structural Information

Molecular Formula
C7H13NO2
SMILES
CC1CNC2(COC2)CO1
InChI
InChI=1S/C7H13NO2/c1-6-2-8-7(5-10-6)3-9-4-7/h6,8H,2-5H2,1H3
InChIKey
SGYYCBJUXXULQP-UHFFFAOYSA-N
Compound name
7-methyl-2,8-dioxa-5-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]+ 144.10192 122.5
[M+Na]+ 166.08386 127.3
[M-H]- 142.08736 126.3
[M+NH4]+ 161.12846 135.1
[M+K]+ 182.05780 131.7
[M+H-H2O]+ 126.09190 112.5
[M+HCOO]- 188.09284 137.7
[M+CH3COO]- 202.10849 172.4
[M+Na-2H]- 164.06931 131.8
[M]+ 143.09409 127.2
[M]- 143.09519 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.