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rac-(1R,6R)-iso-Propyl-anatoxin-a
SpectraBase Compound ID 5IDiLQlkmw4
InChI InChI=1S/C12H19NO/c1-8(2)12(14)10-5-3-4-9-6-7-11(10)13-9/h5,8-9,11,13H,3-4,6-7H2,1-2H3/t9-,11-/m1/s1
InChIKey FXPLTIWFVFSUHR-MWLCHTKSSA-N
Mol Weight 193.29 g/mol
Molecular Formula C12H19NO
Exact Mass 193.146664 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4seL7KTDPyW
Name rac-(1R,6R)-iso-Propyl-anatoxin-a
Appearance Yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H19NO
InChI InChI=1S/C12H19NO/c1-8(2)12(14)10-5-3-4-9-6-7-11(10)13-9/h5,8-9,11,13H,3-4,6-7H2,1-2H3/t9-,11-/m1/s1
InChIKey FXPLTIWFVFSUHR-MWLCHTKSSA-N
Instrument Name Varian 450--240
Ionization Type EI
Literature Reference DOI 10.1021/acs.jnatprod.6b00189
Molecular Weight 193.290 g/mol
SMILES N1[C@]2(CC[C@@]1(C(=CCC2)C(C(C)C)=O)[H])[H]
SPLASH splash10-0fkc-4900000000-59363b5ae9f52ef8ad45
Source of Spectrum G4-79-SM8-SM8-2
Wiley ID 1849380