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16,17-seco-3-Methoxyestra-1,3,5(10)-trien-17-al-(p-Methoxyphenyl)-hydrazone
SpectraBase Compound ID u1AHDjslei
InChI InChI=1S/C27H36N2O2/c1-5-6-26-25-13-7-19-17-22(31-4)12-14-23(19)24(25)15-16-27(26,2)18-28-29-20-8-10-21(30-3)11-9-20/h8-12,14,17-18,24-26,29H,5-7,13,15-16H2,1-4H3/b28-18+/t24-,25-,26+,27-/m1/s1
InChIKey NBNYLLSYUWCQEK-IUNYIAMNSA-N
Mol Weight 420.6 g/mol
Molecular Formula C27H36N2O2
Exact Mass 420.277678 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G68mTAXc0Sd
Name 16,17-seco-3-Methoxyestra-1,3,5(10)-trien-17-al-(p-Methoxyphenyl)-hydrazone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H36N2O2
InChI InChI=1S/C27H36N2O2/c1-5-6-26-25-13-7-19-17-22(31-4)12-14-23(19)24(25)15-16-27(26,2)18-28-29-20-8-10-21(30-3)11-9-20/h8-12,14,17-18,24-26,29H,5-7,13,15-16H2,1-4H3/b28-18+/t24-,25-,26+,27-/m1/s1
InChIKey NBNYLLSYUWCQEK-IUNYIAMNSA-N
Molecular Weight 420.597 g/mol
SMILES N(\N=C\[C@@]1([C@]([C@]2([C@@](c3c(CC2)cc(cc3)OC)(CC1)[H])[H])(CCC)[H])C)c1ccc(OC)cc1
SPLASH splash10-00dj-0260900000-d7ef4882857ddd8c5d12
Source of Spectrum U1-2009-3548-10e
Synonyms N-[(E)-[(1S,2S,4aS,10aR)-7-methoxy-2-methyl-1-propyl-3,4,4a,9,10,10a-hexahydro-1H-phenanthren-2-yl]methylideneamino]-4-methoxyaniline N-[(E)-[(1S,2S,4aS,10aR)-7-methoxy-2-methyl-1-propyl-3,4,4a,9,10,10a-hexahydro-1H-phenanthren-2-yl]methyleneamino]-4-methoxy-aniline N-[(E)-[(1S,2S,4aS,10aR)-7-methoxy-2-methyl-1-propyl-3,4,4a,9,10,10a-hexahydro-1H-phenanthren-2-yl]methylideneamino]-4-methoxy-aniline
Wiley ID 1696943