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]+ 188.09174 139.1
[M+Na]+ 210.07368 143.8
[M-H]- 186.07718 141.1
[M+NH4]+ 205.11828 156.8
[M+K]+ 226.04762 144.4
[M+H-H2O]+ 170.08172 133.8
[M+HCOO]- 232.08266 152.7
[M+CH3COO]- 246.09831 171.8
[M+Na-2H]- 208.05913 144.2
[M]+ 187.08391 133.3
[M]- 187.08501 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.