CID 177789581

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

Structural Information

Molecular Formula
C8H15NO2
SMILES
CC1(CNCC2(O1)COC2)C
InChI
InChI=1S/C8H15NO2/c1-7(2)3-9-4-8(11-7)5-10-6-8/h9H,3-6H2,1-2H3
InChIKey
SENSKDDNJQOJNP-UHFFFAOYSA-N
Compound name
6,6-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]+ 158.11756 128.2
[M+Na]+ 180.09950 133.5
[M-H]- 156.10300 132.3
[M+NH4]+ 175.14410 142.3
[M+K]+ 196.07344 137.7
[M+H-H2O]+ 140.10754 119.1
[M+HCOO]- 202.10848 143.0
[M+CH3COO]- 216.12413 175.1
[M+Na-2H]- 178.08495 137.8
[M]+ 157.10973 133.6
[M]- 157.11083 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.