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6-beta-NALTREXOL

View entire compound with spectra: 1 MS (GC)

6-beta-NALTREXOL
SpectraBase Compound ID 18zrMemAJlq
InChI InChI=1S/C20H25NO4/c22-13-4-3-12-9-15-20(24)6-5-14(23)18-19(20,16(12)17(13)25-18)7-8-21(15)10-11-1-2-11/h3-4,11,14-15,18,22-24H,1-2,5-10H2/t14?,15-,18?,19+,20+/m0/s1
InChIKey JLVNEHKORQFVQJ-GHIIFPFASA-N
Mol Weight 343.42 g/mol
Molecular Formula C20H25NO4
Exact Mass 343.178358 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AQzXeViCU2G
Name 6-beta-NALTREXOL
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C20H25NO4
InChI InChI=1S/C20H25NO4/c22-13-4-3-12-9-15-20(24)6-5-14(23)18-19(20,16(12)17(13)25-18)7-8-21(15)10-11-1-2-11/h3-4,11,14-15,18,22-24H,1-2,5-10H2/t14?,15-,18?,19+,20+/m0/s1
InChIKey JLVNEHKORQFVQJ-GHIIFPFASA-N
Instrument Name GC
Molecular Weight 343.423 g/mol
SMILES OC1C2[C@@]34CCN([C@@](Cc5ccc(c(O2)c35)O)([C@@]4(CC1)O)[H])CC1CC1
SPLASH splash10-0a4m-8974000000-2bc67bfef478dfad237a
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany