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About This Item
Empirical Formula (Hill Notation):
C21D4H28O2
Molecular Weight:
320.50
UNSPSC Code:
12352211
PubChem Substance ID:
NACRES:
NA.12
Product Name
Pregnenolone-2,2,4,4-d4, ≥98 atom % D, ≥95% (CP)
SMILES string
O=C(C)[C@H]1CCC2C3CC=C4C([2H])([2H])[C@@H](O)C([2H])([2H])C[C@]4(C)C3CC[C@@]21C
InChI
1S/C21H32O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h4,15-19,23H,5-12H2,1-3H3/t15-,16?,17+,18?,19?,20-,21+/m0/s1/i8D2,12D2
InChI key
ORNBQBCIOKFOEO-JHAWGCOXSA-N
isotopic purity
≥98 atom % D
assay
≥95% (CP)
form
powder
technique(s)
mass spectrometry (MS): suitable
mass shift
M+4
storage temp.
−20°C
Quality Level
Related Categories
Storage Class
11 - Combustible Solids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
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