CID 155821608

2445794-11-4

Structural Information

Molecular Formula
C15H25NO5
SMILES
CC(C)(C)OC(=O)NCC1CCCC2(O1)CC(C2)C(=O)O
InChI
InChI=1S/C15H25NO5/c1-14(2,3)21-13(19)16-9-11-5-4-6-15(20-11)7-10(8-15)12(17)18/h10-11H,4-9H2,1-3H3,(H,16,19)(H,17,18)
InChIKey
XWOGWNSEVNYTLM-UHFFFAOYSA-N
Compound name
6-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]-5-oxaspiro[3.5]nonane-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

299.17328 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 300.18056 175.6
[M+Na]+ 322.16250 176.9
[M+NH4]+ 317.20710 177.7
[M+K]+ 338.13644 174.7
[M-H]- 298.16600 173.1
[M+Na-2H]- 320.14795 174.4
[M]+ 299.17273 173.6
[M]- 299.17383 173.6
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.