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Norcocaine acetate
SpectraBase Compound ID IVoiGn5s2Ou
InChI InChI=1S/C18H21NO5/c1-11(20)19-13-8-9-14(19)16(18(22)23-2)15(10-13)24-17(21)12-6-4-3-5-7-12/h3-7,13-16H,8-10H2,1-2H3/t13-,14+,15?,16?/m1/s1
InChIKey OHUOYIUXXBLSTC-QVOMUQBLSA-N
Mol Weight 331.37 g/mol
Molecular Formula C18H21NO5
Exact Mass 331.141973 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G53gPQc6QRy
Name Norcocaine acetate
Alternate Name(s) N-Acetylnorcocaine 8-Acetyl-3-benzoyloxy-8-azabicyclo[3.2.1]octane-4-carboxylic acid methyl ester Methyl 8-acetyl-3-(benzoyloxy)-8-azabicyclo[3.2.1]octane-2-carboxylate Methyl 8-acetyl-3-benzoyloxy-8-azabicyclo[3.2.1]octane-4-carboxylate Methyl 8-ethanoyl-3-(phenylcarbonyloxy)-8-azabicyclo[3.2.1]octane-4-carboxylate
CAS Registry Number 137668-43-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H21NO5
InChI InChI=1S/C18H21NO5/c1-11(20)19-13-8-9-14(19)16(18(22)23-2)15(10-13)24-17(21)12-6-4-3-5-7-12/h3-7,13-16H,8-10H2,1-2H3/t13-,14+,15?,16?/m1/s1
InChIKey OHUOYIUXXBLSTC-QVOMUQBLSA-N
Molecular Weight 331.368 g/mol
SMILES CC(N1[C@@]2(CC[C@]1(C(C(C2)OC(c1ccccc1)=O)C(=O)OC)[H])[H])=O
SPLASH splash10-0aor-5910000000-74801ab4de2bb779116b
Source of Spectrum JZ-1992-4860-0
Wiley ID 1328700