Cis-2,3 dihydrotetrabenazine 13C2 D6

ISO 17034:
Catalog Number : CS-O-07001
CAS Number : 113627-25-1(Unlabeled)
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What is the Chemical Information of Cis-2,3 dihydrotetrabenazine 13C2 D6?

Chemical Name : Cis-2,3 dihydrotetrabenazine 13C2 D6
Category : Stable Isotopes
Synonyms : "(+)-β-Dihydro tetrabenazine 13C2,D6;"
Molecular Weight : 327.46 mol/g
Molecular Formula : C₁₇¹³C₂H₂₃D₆NO₃
Application : "Labeled Tetrabenazine, intended for use as an internal standard for the quantification of Tetrabenazine by GC- or LC-mass spectrometry."

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Canonical SMILES : CC(C)CC1CN2CCC3=CC(=C(C=C3C2CC1O)OC)OC
Isomeric SMILES : CC(C)C[C@H]1CN2CCC3=CC(=C(C=C3[C@@H]2C[C@H]1O)OC)OC
InChI : InChI=1S/C19H29NO3/c1-12(2)7-14-11-20-6-5-13-8-18(22-3)19(23-4)9-15(13)16(20)10-17(14)21/h8-9,12,14,16-17,21H,5-7,10-11H2,1-4H3/t14-,16-,17+/m0/s1
InchIKey : WEQLWGNDNRARGE-BHYGNILZSA-N
IUPAC Name : (2R,3S,11bS)-9,10-dimethoxy-3-(2-methylpropyl)-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-ol
Exact Mass : 319.21474379