CID 165593311

3-(methoxymethyl)-1-azaspiro[3.3]heptane

Structural Information

Molecular Formula
C8H15NO
SMILES
COCC1CNC12CCC2
InChI
InChI=1S/C8H15NO/c1-10-6-7-5-9-8(7)3-2-4-8/h7,9H,2-6H2,1H3
InChIKey
UFUBBUFBQVBEDP-UHFFFAOYSA-N
Compound name
3-(methoxymethyl)-1-azaspiro[3.3]heptane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

141.11537 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.12265 123.8
[M+Na]+ 164.10459 128.2
[M-H]- 140.10809 126.7
[M+NH4]+ 159.14919 132.4
[M+K]+ 180.07853 132.2
[M+H-H2O]+ 124.11263 110.7
[M+HCOO]- 186.11357 140.3
[M+CH3COO]- 200.12922 184.9
[M+Na-2H]- 162.09004 130.5
[M]+ 141.11482 137.9
[M]- 141.11592 137.9
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.