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6-Methyl-8-.beta.-(methylthiomethyl)oxyergoline
SpectraBase Compound ID Jy7zqu7qqCF
InChI InChI=1S/C17H22N2OS/c1-19-9-12(20-10-21-2)7-14-13-4-3-5-15-17(13)11(8-18-15)6-16(14)19/h3-5,8,12,14,16,18H,6-7,9-10H2,1-2H3/t12-,14?,16-/m1/s1
InChIKey VTUIBJMFPBTMLP-QXDOLYAVSA-N
Mol Weight 302.44 g/mol
Molecular Formula C17H22N2OS
Exact Mass 302.145285 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5gBUWQ3M9Hh
Name 6-Methyl-8-.beta.-(methylthiomethyl)oxyergoline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22N2OS
InChI InChI=1S/C17H22N2OS/c1-19-9-12(20-10-21-2)7-14-13-4-3-5-15-17(13)11(8-18-15)6-16(14)19/h3-5,8,12,14,16,18H,6-7,9-10H2,1-2H3/t12-,14?,16-/m1/s1
InChIKey VTUIBJMFPBTMLP-QXDOLYAVSA-N
Molecular Weight 302.436 g/mol
SMILES [nH]1c2cccc3c2c(c1)C[C@@]1(C3C[C@](CN1C)(OCSC)[H])[H]
SPLASH splash10-0ufs-1971000000-dede860df7a8ab17a02d
Source of Spectrum Y-29-457-0
Synonyms (8beta)-6-methyl-8-[(methylsulfanyl)methoxy]ergoline
Wiley ID 1304707