CID 165984598

9,9-dimethyl-2,5-dioxa-8-azaspiro[3.5]nonane

Structural Information

Molecular Formula
C8H15NO2
SMILES
CC1(C2(COC2)OCCN1)C
InChI
InChI=1S/C8H15NO2/c1-7(2)8(5-10-6-8)11-4-3-9-7/h9H,3-6H2,1-2H3
InChIKey
YWMXTDCEPWEQHT-UHFFFAOYSA-N
Compound name
9,9-dimethyl-2,5-dioxa-8-azaspiro[3.5]nonane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

157.11028 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.117556 128.2
[M+Na]+ 180.099498 133.5
[M-H]- 156.103004 132.3
[M+NH4]+ 175.144103 142.3
[M+K]+ 196.073438 137.7
[M+H-H2O]+ 140.107540 119.1
[M+HCOO]- 202.108481 143.0
[M+CH3COO]- 216.124131 175.1
[M+Na-2H]- 178.084946 137.8
[M]+ 157.10973142 133.6
[M]- 157.11082858 133.6
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.