CID 146075362

2172113-22-1

Structural Information

Molecular Formula

C₁₄H₂₄N₂O₄

SMILES

CC(C)(C)OC(=O)N1CC(C2(C1)CCN(C2)C)C(=O)O

InChI

InChI=1S/C14H24N2O4/c1-13(2,3)20-12(19)16-7-10(11(17)18)14(9-16)5-6-15(4)8-14/h10H,5-9H2,1-4H3,(H,17,18)

InChIKey

REEVDKPQMGJTAN-UHFFFAOYSA-N

Compound name

7-methyl-2-[(2-methylpropan-2-yl)oxycarbonyl]-2,7-diazaspiro[4.4]nonane-4-carboxylic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 284.1736 Da
Monoisotopic Mass: -1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	285.180876	168.3
[M+Na]+	307.162818	173.8
[M-H]-	283.166324	169.9
[M+NH4]+	302.207423	186.7
[M+K]+	323.136758	172.9
[M+H-H2O]+	267.170860	163.3
[M+HCOO]-	329.171801	181.9
[M+CH3COO]-	343.187451	195.4
[M+Na-2H]-	305.148266	166.8
[M]+	284.17305142	166.7
[M]-	284.17414858	166.7

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.