CID 154856840

2490374-70-2

Structural Information

Molecular Formula
C8H13NO4
SMILES
C1CNCC12COCC(O2)C(=O)O
InChI
InChI=1S/C8H13NO4/c10-7(11)6-3-12-5-8(13-6)1-2-9-4-8/h6,9H,1-5H2,(H,10,11)
InChIKey
UEYIJIWWCHUGJK-UHFFFAOYSA-N
Compound name
6,9-dioxa-2-azaspiro[4.5]decane-7-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

187.08446 Da
Monoisotopic Mass

-3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.091736 139.1
[M+Na]+ 210.073678 143.8
[M-H]- 186.077184 141.1
[M+NH4]+ 205.118283 156.8
[M+K]+ 226.047618 144.4
[M+H-H2O]+ 170.081720 133.8
[M+HCOO]- 232.082661 152.7
[M+CH3COO]- 246.098311 171.8
[M+Na-2H]- 208.059126 144.2
[M]+ 187.08391142 133.3
[M]- 187.08500858 133.3
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.