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Product Overview

Product Code

CDN-D-5174

CAS Number

1219799-27-5

Product Format

Neat

Molecular Formula

C18 D2 H18 O2

Molecular Weight

270.3625

Product Categories

Hormones & derivatives, Stable isotopes

Product Type

Stable Isotope Labelled

Unlabelled CAS Number

474-87-3

Purity

96 atom % D, min 94% Chemical Purity

Documentation

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Product Information

Analyte Data

Analyte Name

Delta8,9-Dehydroestrone-16,16-D2

CAS Number

1219799-27-5

Molecular Formula

C18 D2 H18 O2

Molecular Weight

270.3625

Accurate Mass

270.1589

SMILES

[2H]C1([2H])C[C@H]2C3=C(CC[C@]2(C)C1=O)c4ccc(O)cc4CC3

InChI

InChI=1S/C18H20O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3,5,10,16,19H,2,4,6-9H2,1H3/t16-,18-/m0/s1/i7D2

IUPAC

(13S,14S)-16,16-dideuterio-3-hydroxy-13-methyl-6,7,11,12,14,15-hexahydrocyclopenta[a]phenanthren-17-one

Unlabelled CAS Number

474-87-3

SIL Type

Deuterium

Product Data

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

Purity

96 atom % D, min 94% Chemical Purity

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