CID 121553836

3-methoxyspiro[3.3]heptan-1-amine hydrochloride

Structural Information

Molecular Formula
C8H15NO
SMILES
COC1CC(C12CCC2)N
InChI
InChI=1S/C8H15NO/c1-10-7-5-6(9)8(7)3-2-4-8/h6-7H,2-5,9H2,1H3
InChIKey
PTFYUPFXMGLEIK-UHFFFAOYSA-N
Compound name
3-methoxyspiro[3.3]heptan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

141.11537 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.12265 124.7
[M+Na]+ 164.10459 128.9
[M-H]- 140.10809 129.8
[M+NH4]+ 159.14919 134.6
[M+K]+ 180.07853 133.7
[M+H-H2O]+ 124.11263 111.6
[M+HCOO]- 186.11357 143.7
[M+CH3COO]- 200.12922 189.4
[M+Na-2H]- 162.09004 130.1
[M]+ 141.11482 138.5
[M]- 141.11592 138.5
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.