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9,10-Ethanoanthracene-9(10H)-ethanol, 3-hydroxy-.alpha.-[(methylamino)methyl]-, [9.alpha.(S*),10.beta.]-
SpectraBase Compound ID KjMAlzfkPxx
InChI InChI=1S/C20H23NO2/c1-21-12-14(23)11-20-9-8-15(16-4-2-3-5-18(16)20)17-10-13(22)6-7-19(17)20/h2-7,10,14-15,21-23H,8-9,11-12H2,1H3/t14-,15-,20+/m0/s1
InChIKey XQTRKEYERMHWBB-AUSJPIAWSA-N
Mol Weight 309.41 g/mol
Molecular Formula C20H23NO2
Exact Mass 309.172879 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3We76gjPXnV
Name 9,10-Ethanoanthracene-9(10H)-ethanol, 3-hydroxy-.alpha.-[(methylamino)methyl]-, [9.alpha.(S*),10.beta.]-
CAS Registry Number 94840-82-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H23NO2
InChI InChI=1S/C20H23NO2/c1-21-12-14(23)11-20-9-8-15(16-4-2-3-5-18(16)20)17-10-13(22)6-7-19(17)20/h2-7,10,14-15,21-23H,8-9,11-12H2,1H3/t14-,15-,20+/m0/s1
InChIKey XQTRKEYERMHWBB-AUSJPIAWSA-N
Molecular Weight 309.409 g/mol
SMILES Oc1cc2c([C@@]3(C[C@@](CNC)(O)[H])CC[C@@]2([H])c2c3cccc2)cc1
SPLASH splash10-05di-9263000000-c9bdf1079dfec402d1d4
Source of Spectrum H-67-2086-0
Synonyms (1S,8R)-8-[(2S)-2-hydroxy-3-(methylamino)propyl]tetracyclo[6.6.2.0(2,7).0(9,14)]hexadeca-2,4,6,9,11,13-hexaen-4-ol (9R*,2'S*)-3-Hydroxyoxaprotiline
Wiley ID 1310828