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(1R,2R,6S,7R,9R)-4,4-Dimethyl-8-[(S)-1-phenylethyl]-3,5-dioxa-8-azatricyclo[5.2.1.0(2,6)]decane-9-carboxylic acid methyl ester

View entire compound with spectra: 1 MS (GC)

(1R,2R,6S,7R,9R)-4,4-Dimethyl-8-[(S)-1-phenylethyl]-3,5-dioxa-8-azatricyclo[5.2.1.0(2,6)]decane-9-carboxylic acid methyl ester
SpectraBase Compound ID 2276a8sx3Zu
InChI InChI=1S/C19H25NO4/c1-11(12-8-6-5-7-9-12)20-14-10-13(15(20)18(21)22-4)16-17(14)24-19(2,3)23-16/h5-9,11,13-17H,10H2,1-4H3/t11-,13+,14+,15+,16+,17-/m0/s1
InChIKey MXPBHTWIMYEJNB-HJHUUBBFSA-N
Mol Weight 331.41 g/mol
Molecular Formula C19H25NO4
Exact Mass 331.178358 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L9JzbjhBQ1P
Name (1R,2R,6S,7R,9R)-4,4-Dimethyl-8-[(S)-1-phenylethyl]-3,5-dioxa-8-azatricyclo[5.2.1.0(2,6)]decane-9-carboxylic acid methyl ester
Alternate Name(s) Methyl (1R,2R,6S,7R,9R)-4,4-dimethyl-8-[(1S)-1-phenylethyl]-3,5-dioxa-8-azatricyclo[5.2.1.0(2,6)]decane-9-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H25NO4
InChI InChI=1S/C19H25NO4/c1-11(12-8-6-5-7-9-12)20-14-10-13(15(20)18(21)22-4)16-17(14)24-19(2,3)23-16/h5-9,11,13-17H,10H2,1-4H3/t11-,13+,14+,15+,16+,17-/m0/s1
InChIKey MXPBHTWIMYEJNB-HJHUUBBFSA-N
Molecular Weight 331.412 g/mol
SMILES [C@]12(N([C@]([C@@]([C@]3(OC(O[C@@]23[H])(C)C)[H])([H])C1)(C(=O)OC)[H])[C@](c1ccccc1)(C)[H])[H]
SPLASH splash10-053r-1963000000-a4621f8a492b221641d8
Source of Spectrum QE-7-1434-4
Wiley ID 845585