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3-Mandeloyloxy-6,7-dimethoxytropane
SpectraBase Compound ID 35aOUO7qRsY
InChI InChI=1S/C18H25NO5/c1-19-13-9-12(10-14(19)17(23-3)16(13)22-2)24-18(21)15(20)11-7-5-4-6-8-11/h4-8,12-17,20H,9-10H2,1-3H3/t12?,13-,14+,15?,16-,17+
InChIKey WWTLXBGHBICOAW-BQNZIEKESA-N
Mol Weight 335.4 g/mol
Molecular Formula C18H25NO5
Exact Mass 335.173273 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1k08hkADVQ
Name 3-Mandeloyloxy-6,7-dimethoxytropane
Alternate Name(s) 6,7-Dimethoxy-8-methyl-8-azabicyclo[3.2.1]oct-3-yl hydroxy(phenyl)acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H25NO5
InChI InChI=1S/C18H25NO5/c1-19-13-9-12(10-14(19)17(23-3)16(13)22-2)24-18(21)15(20)11-7-5-4-6-8-11/h4-8,12-17,20H,9-10H2,1-3H3/t12?,13-,14+,15?,16-,17+
InChIKey WWTLXBGHBICOAW-BQNZIEKESA-N
Molecular Weight 335.400 g/mol
SMILES OC(C(OC1C[C@]2(N([C@]([C@](OC)([C@@]2(OC)[H])[H])(C1)[H])C)[H])=O)c1ccccc1
SPLASH splash10-0005-9000000000-a7e3398510c667150622
Source of Spectrum SI-39-77-0
Wiley ID 1331664