CID 138991154

2309462-43-7

Structural Information

Molecular Formula
C9H15NO3
SMILES
C1CC2(C1)CNCC(O2)CC(=O)O
InChI
InChI=1S/C9H15NO3/c11-8(12)4-7-5-10-6-9(13-7)2-1-3-9/h7,10H,1-6H2,(H,11,12)
InChIKey
BYLWERGVLXRGMI-UHFFFAOYSA-N
Compound name
2-(5-oxa-8-azaspiro[3.5]nonan-6-yl)acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

185.1052 Da
Monoisotopic Mass

-2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.11248 138.0
[M+Na]+ 208.09442 141.1
[M-H]- 184.09792 139.3
[M+NH4]+ 203.13902 149.1
[M+K]+ 224.06836 143.6
[M+H-H2O]+ 168.10246 127.4
[M+HCOO]- 230.10340 151.1
[M+CH3COO]- 244.11905 177.7
[M+Na-2H]- 206.07987 143.3
[M]+ 185.10465 140.9
[M]- 185.10575 140.9
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.