Asenapine-13C,d3 Maleate

Analyte Name

Asenapine-13C,d3 Maleate

Molecular Formula

13C C16 D3 H13 Cl N O . C4 H3 O4

Molecular Weight

404.843

Accurate Mass

404.117

SMILES

[2H][13C]([2H])([2H])N1C[C@H]2[C@H](C1)c3cc(Cl)ccc3Oc4ccccc24.OC(=O)\C=[C]/C(=O)O

InChI

InChI=1S/C17H16ClNO.C4H3O4/c1-19-9-14-12-4-2-3-5-16(12)20-17-7-6-11(18)8-13(17)15(14)10-19;5-3(6)1-2-4(7)8/h2-8,14-15H,9-10H2,1H3;1H,(H,5,6)(H,7,8)/t14-,15-;/m1./s1/i1+1D3;

IUPAC

(Z)-but-2-enedioic acid;(2S,6S)-9-chloro-4-(trideuterio(113C)methyl)-13-oxa-4-azatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),7(12),8,10,15,17-hexaene

Unlabelled CAS Number

85650-56-2

SIL Type

Carbon, Deuterium

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat