CID 7015505

8-amino-1,4-dioxaspiro[4.5]decane-8-carboxylic acid

Structural Information

Molecular Formula
C9H15NO4
SMILES
C1CC2(CCC1(C(=O)O)N)OCCO2
InChI
InChI=1S/C9H15NO4/c10-8(7(11)12)1-3-9(4-2-8)13-5-6-14-9/h1-6,10H2,(H,11,12)
InChIKey
HIIFALCQUKTUHB-UHFFFAOYSA-N
Compound name
8-amino-1,4-dioxaspiro[4.5]decane-8-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

110
Patents

201.10011 Da
Monoisotopic Mass

-2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.10739 143.5
[M+Na]+ 224.08933 150.3
[M+NH4]+ 219.13393 153.2
[M+K]+ 240.06327 145.9
[M-H]- 200.09283 146.7
[M+Na-2H]- 222.07478 147.8
[M]+ 201.09956 145.2
[M]- 201.10066 145.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

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Patent stripe

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