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Norcocaine
SpectraBase Compound ID 6i2I7GLwkYg
InChI InChI=1S/C16H19NO4/c1-20-16(19)14-12-8-7-11(17-12)9-13(14)21-15(18)10-5-3-2-4-6-10/h2-6,11-14,17H,7-9H2,1H3/t11-,12+,13-,14+/m0/s1
InChIKey AYDBLCSLKNTEJL-RFQIPJPRSA-N
Mol Weight 289.33 g/mol
Molecular Formula C16H19NO4
Exact Mass 289.131408 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L5LjHhZfMQ8
Name (-)-Norcocaine
CAS Registry Number 18717-72-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H19NO4
InChI InChI=1S/C16H19NO4/c1-20-16(19)14-12-8-7-11(17-12)9-13(14)21-15(18)10-5-3-2-4-6-10/h2-6,11-14,17H,7-9H2,1H3/t11-,12+,13-,14+/m0/s1
InChIKey AYDBLCSLKNTEJL-RFQIPJPRSA-N
Molecular Weight 289.331 g/mol
SMILES N1[C@@]2(C[C@@]([C@@]([C@]1(CC2)[H])(C(=O)OC)[H])(OC(=O)c1ccccc1)[H])[H]
SPLASH splash10-014i-9800000000-bc9d56c1acd8017c7a5d
Synonyms 1-.alpha.-H,5-.alpha.-H-Nortropane-2-.beta.-carboxylic acid, 3-.beta.-hydroxy-, methyl ester,benzoate 3-Benzoyloxy-8-azabicyclo[3.2.1]octane-4-carboxylic acid methyl ester 8-Azabicyclo[3.2.1]octane-2-carboxylic acid, 3-(benzoyloxy)-, methyl ester, [1R-(exo,exo)]- Methyl 3-(phenylcarbonyloxy)-8-azabicyclo[3.2.1]octane-4-carboxylate Methyl 3-benzoyloxy-8-azabicyclo[3.2.1]octane-4-carboxylate
Wiley ID 1510020