CID 132351134

2110261-55-5

Structural Information

Molecular Formula
C7H13NO2
SMILES
C1CC2(COC2)OC1CN
InChI
InChI=1S/C7H13NO2/c8-3-6-1-2-7(10-6)4-9-5-7/h6H,1-5,8H2
InChIKey
OGAWTRZKWRHEKO-UHFFFAOYSA-N
Compound name
2,5-dioxaspiro[3.4]octan-6-ylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

143.09464 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.10192 121.9
[M+Na]+ 166.08386 126.7
[M-H]- 142.08736 128.1
[M+NH4]+ 161.12846 137.6
[M+K]+ 182.05780 131.1
[M+H-H2O]+ 126.09190 113.0
[M+HCOO]- 188.09284 142.1
[M+CH3COO]- 202.10849 176.0
[M+Na-2H]- 164.06931 129.8
[M]+ 143.09409 128.1
[M]- 143.09519 128.1
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.