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#9;DPET;(5R,6R,7R,9R,13S,14R,20R)-(5-ALPHA,7-ALPHA)-4,5-EPOXY-6-HYDROXY-3-METHOXY-ALPHA,17-DIMETHYL-ALPHA-(2-PHENYLETHYL)-6,14-ETHENO-MORPHINAN-7-METHAN
SpectraBase Compound ID Cbsk44bI5pO
InChI InChI=1S/C30H35NO4/c1-27(32,12-11-19-7-5-4-6-8-19)22-18-28-13-14-30(22,33)26-29(28)15-16-31(2)23(28)17-20-9-10-21(34-3)25(35-26)24(20)29/h4-10,13-14,22-23,26,32-33H,11-12,15-18H2,1-3H3/t22-,23-,26-,27?,28-,29+,30+/m1/s1
InChIKey ZQWVXXKJRGWLBZ-WYROTTDFSA-N
Mol Weight 473.6 g/mol
Molecular Formula C30H35NO4
Exact Mass 473.256609 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5xU9aiLfL4j
Name #9;DPET;(5R,6R,7R,9R,13S,14R,20R)-(5-ALPHA,7-ALPHA)-4,5-EPOXY-6-HYDROXY-3-METHOXY-ALPHA,17-DIMETHYL-ALPHA-(2-PHENYLETHYL)-6,14-ETHENO-MORPHINAN-7-METHAN
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H35NO4
InChI InChI=1S/C30H35NO4/c1-27(32,12-11-19-7-5-4-6-8-19)22-18-28-13-14-30(22,33)26-29(28)15-16-31(2)23(28)17-20-9-10-21(34-3)25(35-26)24(20)29/h4-10,13-14,22-23,26,32-33H,11-12,15-18H2,1-3H3/t22-,23-,26-,27?,28-,29+,30+/m1/s1
InChIKey ZQWVXXKJRGWLBZ-WYROTTDFSA-N
Literature Reference Author J.MARTON,G.HENRIKSEN
Literature Reference Citation MOLECULES,17,11554(2012)
Literature Reference DOI 10.3390/molecules171011554
Molecular Weight 473.612 g/mol
Sample ID 819
Solvent CDCl3