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3,6-Dicinnamoyloxytropane
SpectraBase Compound ID JOanynk5k07
InChI InChI=1S/C26H27NO4/c1-27-21-16-22(30-25(28)14-12-19-8-4-2-5-9-19)18-23(27)24(17-21)31-26(29)15-13-20-10-6-3-7-11-20/h2-15,21-24H,16-18H2,1H3/b14-12+,15-13+/t21-,22?,23+,24-/m1/s1
InChIKey ZHJUOEJQLDHSBJ-UEZBOBJQSA-N
Mol Weight 417.51 g/mol
Molecular Formula C26H27NO4
Exact Mass 417.194008 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IOiZPQeiVfE
Name 3,6-Dicinnamoyloxytropane
Alternate Name(s) 8-Methyl-3-{[(2E)-3-phenyl-2-propenoyl]oxy}-8-azabicyclo[3.2.1]oct-6-yl (2E)-3-phenyl-2-propenoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H27NO4
InChI InChI=1S/C26H27NO4/c1-27-21-16-22(30-25(28)14-12-19-8-4-2-5-9-19)18-23(27)24(17-21)31-26(29)15-13-20-10-6-3-7-11-20/h2-15,21-24H,16-18H2,1H3/b14-12+,15-13+/t21-,22?,23+,24-/m1/s1
InChIKey ZHJUOEJQLDHSBJ-UEZBOBJQSA-N
Molecular Weight 417.505 g/mol
SMILES [C@@]12(N([C@@](C[C@]2(OC(\C=C\c2ccccc2)=O)[H])(CC(OC(\C=C\c2ccccc2)=O)C1)[H])C)[H]
SPLASH splash10-00ke-9210300000-341022e04230fdd15a37
Source of Spectrum SI-39-77-0
Wiley ID 1376899