Product Code

TRC-A788017

CAS Number

1391745-00-8

Product Format

Neat

Molecular Formula

13C C16 D3 H13 Cl N O5 S

Molecular Weight

385.842

Product Categories

TRC, Stable isotopes, API Reference Standards & Research Materials

Product Type

Stable Isotope Labelled, Contaminant

Price and availability

48-hour USA dispatch time

Freight restricted.

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Product Information

Chemical Data

Analyte Name

Asenapine 11-Hydroxysulfate-13CD3

CAS Number

1391745-00-8

Molecular Formula

13C C16 D3 H13 Cl N O5 S

Molecular Weight

385.842

Accurate Mass

385.066

SMILES

[2H][13C]([2H])([2H])N1C[C@@H]2[C@@H](C1)c3cc(OS(=O)(=O)O)ccc3Oc4ccc(Cl)cc24

InChI

InChI=1S/C17H16ClNO5S/c1-19-8-14-12-6-10(18)2-4-16(12)23-17-5-3-11(24-25(20,21)22)7-13(17)15(14)9-19/h2-7,14-15H,8-9H2,1H3,(H,20,21,22)/t14-,15-/m0/s1/i1+1D3

IUPAC

[(2R,6R)-17-chloro-4-(trideuterio(113C)methyl)-13-oxa-4-azatetracyclo[12.4.0.02,6.07,12]octadeca-1(18),7(12),8,10,14,16-hexaen-9-yl] hydrogen sulfate

SIL Type

Deuterium, Carbon

Product Data

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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Asenapine 11-Hydroxysulfate-13CD3

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