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(DH3)Cocaine(O-CD3)
SpectraBase Compound ID IjmDIpHLQyV
InChI InChI=1S/C17H21NO4/c1-18-12-8-9-13(18)15(17(20)21-2)14(10-12)22-16(19)11-6-4-3-5-7-11/h3-7,12-15H,8-10H2,1-2H3/t12-,13+,14-,15+/m1/s1/i2D3
InChIKey ZPUCINDJVBIVPJ-DTYOMDQWSA-N
Mol Weight 306.38 g/mol
Molecular Formula C17H182D3NO4
Exact Mass 306.165888 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID UjhGw0pPT8
Name (DH3)Cocaine(O-CD3)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18D3NO4
InChI InChI=1S/C17H21NO4/c1-18-12-8-9-13(18)15(17(20)21-2)14(10-12)22-16(19)11-6-4-3-5-7-11/h3-7,12-15H,8-10H2,1-2H3/t12-,13+,14-,15+/m1/s1/i2D3
InChIKey ZPUCINDJVBIVPJ-DTYOMDQWSA-N
Molecular Weight 306.376 g/mol
SMILES [C@@]12([C@@]([C@](OC(=O)c3ccccc3)(C[C@](N1C)(CC2)[H])[H])(C(=O)OC([2D])([2D])[2D])[H])[H]
SPLASH splash10-052r-0912000000-7a818b3c03a1819501eb
Source of Spectrum KO-5-659-1
Wiley ID 1305672