CID 130585754

2-{5-oxaspiro[3.4]octan-6-yl}ethan-1-amine

Structural Information

Molecular Formula
C9H17NO
SMILES
C1CC2(C1)CCC(O2)CCN
InChI
InChI=1S/C9H17NO/c10-7-3-8-2-6-9(11-8)4-1-5-9/h8H,1-7,10H2
InChIKey
WXJJPWGLEPNVCT-UHFFFAOYSA-N
Compound name
2-(5-oxaspiro[3.4]octan-6-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

155.13101 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.13829 130.0
[M+Na]+ 178.12023 134.1
[M-H]- 154.12373 135.4
[M+NH4]+ 173.16483 146.6
[M+K]+ 194.09417 136.6
[M+H-H2O]+ 138.12827 120.7
[M+HCOO]- 200.12921 150.3
[M+CH3COO]- 214.14486 179.8
[M+Na-2H]- 176.10568 135.7
[M]+ 155.13046 134.9
[M]- 155.13156 134.9
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.