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1,1-Dideuteriotetrabenazine
SpectraBase Compound ID K4WjsQGnpk9
InChI InChI=1S/C19H27NO3/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/h8-9,12,14,16H,5-7,10-11H2,1-4H3/i10D2
InChIKey MKJIEFSOBYUXJB-KBMKNGFXSA-N
Mol Weight 319.44 g/mol
Molecular Formula C19H252D2NO3
Exact Mass 319.211647 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B2S56z09C76
Name 1,1-Dideuteriotetrabenazine
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H25D2NO3
InChI InChI=1S/C19H27NO3/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/h8-9,12,14,16H,5-7,10-11H2,1-4H3/i10D2
InChIKey MKJIEFSOBYUXJB-KBMKNGFXSA-N
Molecular Weight 319.441 g/mol
SMILES C12N(CCc3cc(c(cc23)OC)OC)CC(C(C1([2D])[2D])=O)CC(C)C
SPLASH splash10-03dl-0891000000-e5de4fb6f30e36cbf3f2
Source of Spectrum JC-493-394-1
Wiley ID 1317807