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20(R)-Ethoxy-7.alpha.-ethyl-6,14-endoethenotetrahydrooropavine
SpectraBase Compound ID 7EOX6s3NQal
InChI InChI=1S/C24H31NO4/c1-5-28-14(2)16-13-22-8-9-24(16,27-4)21-23(22)10-11-25(3)18(22)12-15-6-7-17(26)20(29-21)19(15)23/h6-9,14,16,18,21,26H,5,10-13H2,1-4H3/t14-,16+,18-,21-,22+,23+,24+/m1/s1
InChIKey YLGFGFSODXCCQV-UTHJOZAFSA-N
Mol Weight 397.52 g/mol
Molecular Formula C24H31NO4
Exact Mass 397.225308 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID mZecpPtKa
Name 20(R)-Ethoxy-7.alpha.-ethyl-6,14-endoethenotetrahydrooropavine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H31NO4
InChI InChI=1S/C24H31NO4/c1-5-28-14(2)16-13-22-8-9-24(16,27-4)21-23(22)10-11-25(3)18(22)12-15-6-7-17(26)20(29-21)19(15)23/h6-9,14,16,18,21,26H,5,10-13H2,1-4H3/t14-,16+,18-,21-,22+,23+,24+/m1/s1
InChIKey YLGFGFSODXCCQV-UTHJOZAFSA-N
Molecular Weight 397.515 g/mol
SMILES Oc1c2c3[C@]45[C@@]6([C@](N(CC5)C)(Cc3cc1)[H])C=C[C@@]([C@@]4(O2)[H])([C@]([C@](OCC)(C)[H])(C6)[H])OC
SPLASH splash10-00xs-2359000000-4d2feeecfcd2c1ef6635
Source of Spectrum F2-43-1856-5
Wiley ID 1600622