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About This Item
Linear Formula:
13CH3CH(CD3)COCO2Na
Molecular Weight:
142.11
NACRES:
NA.12
PubChem Substance ID:
UNSPSC Code:
12352106
MDL number:
Isotopic purity:
99 atom % 13C, 98 atom % D
Mass shift:
M+4
Form:
solid
Quality Segment
isotopic purity
99 atom % 13C, 98 atom % D
form
solid
technique(s)
bio NMR: suitable
mp
227-230 °C (lit.)
mass shift
M+4
SMILES string
[Na+].[2H]C([2H])([2H])C([13CH3])C(=O)C([O-])=O
InChI
1S/C5H8O3.Na/c1-3(2)4(6)5(7)8;/h3H,1-2H3,(H,7,8);/q;+1/p-1/i1D3,2+1;
InChI key
WIQBZDCJCRFGKA-CKHMYQJJSA-M
Storage Class
11 - Combustible Solids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
Eyeshields, Gloves, type N95 (US)
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