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(+)-9-Benzyl 2-methyl 3-hydroxy-9-azabicyclo[3.3.1]non-2-ene-(+)-2,9-dicarboxylate

View entire compound with spectra: 1 MS (GC)

(+)-9-Benzyl 2-methyl 3-hydroxy-9-azabicyclo[3.3.1]non-2-ene-(+)-2,9-dicarboxylate
SpectraBase Compound ID oo2huv6x35
InChI InChI=1S/C18H21NO5/c1-23-17(21)16-14-9-5-8-13(10-15(16)20)19(14)18(22)24-11-12-6-3-2-4-7-12/h2-4,6-7,13-14,20H,5,8-11H2,1H3/t13-,14+/m1/s1
InChIKey RUXAILFDDRSAAF-KGLIPLIRSA-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 JebHLfKloRS
Name (+)-9-Benzyl 2-methyl 3-hydroxy-9-azabicyclo[3.3.1]non-2-ene-(+)-2,9-dicarboxylate
Alternate Name(s) 9-Benzyl 2-methyl 3-hydroxy-9-azabicyclo[3.3.1]non-2-ene-2,9-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H21NO5
InChI InChI=1S/C18H21NO5/c1-23-17(21)16-14-9-5-8-13(10-15(16)20)19(14)18(22)24-11-12-6-3-2-4-7-12/h2-4,6-7,13-14,20H,5,8-11H2,1H3/t13-,14+/m1/s1
InChIKey RUXAILFDDRSAAF-KGLIPLIRSA-N
Molecular Weight 331.368 g/mol
SMILES OC1=C([C@]2(N(C(OCc3ccccc3)=O)[C@@](C1)(CCC2)[H])[H])C(=O)OC
SPLASH splash10-0006-9100000000-13e39e1d10d77daa79c6
Source of Spectrum KC-0-1572-18
Wiley ID 786014