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809667

Chenodeoxycholic-2,2,3,4,4,6,6,7,8-d9 acid

≥98 atom % D, ≥98% (CP)

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About This Item

Empirical Formula (Hill Notation):
C24D9H31O4
Molecular Weight:
401.63
UNSPSC Code:
12352106
PubChem Substance ID:
329769176
NACRES:
NA.12
Isotopic purity:
≥98 atom % D
Assay:
≥98% (CP)
Mass shift:
M+9
Form:
solid
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isotopic purity

≥98 atom % D

Quality Segment

assay

≥98% (CP)

form

solid

technique(s)

mass spectrometry (MS): suitable

mass shift

M+9

storage temp.

−20°C

SMILES string

[2H]C1([2H])[C@@]([2H])(O)C([2H])([2H])C(C([2H])([2H])[C@@]([2H])(O)C2([2H])C3CC[C@@]4(C)C2CC[C@@H]4[C@H](C)CCC(O)=O)[C@]3(C)C1

InChI

1S/C24H40O4/c1-14(4-7-21(27)28)17-5-6-18-22-19(9-11-24(17,18)3)23(2)10-8-16(25)12-15(23)13-20(22)26/h14-20,22,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15?,16-,17-,18?,19?,20-,22?,23+,24-/m1/s1/i8D2,12D2,13D2,16D,20D,22D

InChI key

RUDATBOHQWOJDD-CJJOGGQHSA-N

Storage Class

11 - Combustible Solids

WGK

WGK 3

Flash Point (°F)

Not applicable

Flash Point (°C)

Not applicable

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