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]+ 142.122646 123.8
[M+Na]+ 164.104588 128.2
[M-H]- 140.108094 126.7
[M+NH4]+ 159.149193 132.4
[M+K]+ 180.078528 132.2
[M+H-H2O]+ 124.112630 110.7
[M+HCOO]- 186.113571 140.3
[M+CH3COO]- 200.129221 184.9
[M+Na-2H]- 162.090036 130.5
[M]+ 141.11482142 137.9
[M]- 141.11591858 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.