Methyl-[2H3]-homoanatoxin-a

SpectraBase Compound ID	5pgv5757lZe
InChI	InChI=1S/C11H17NO/c1-2-11(13)9-5-3-4-8-6-7-10(9)12-8/h5,8,10,12H,2-4,6-7H2,1H3/t8-,10-/m1/s1/i1D3
InChIKey	VVMQRZZXKNDPOT-UPVVNVLGSA-N Google Search
Mol Weight	182.28 g/mol
Molecular Formula	C11H14D3NO
Exact Mass	182.149844 g/mol

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SpectraBase Spectrum ID	JfkLSXBOVXf
Name	Methyl-[2H3]-homoanatoxin-a
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C11H14D3NO
InChI	InChI=1S/C11H17NO/c1-2-11(13)9-5-3-4-8-6-7-10(9)12-8/h5,8,10,12H,2-4,6-7H2,1H3/t8-,10-/m1/s1/i1D3
InChIKey	VVMQRZZXKNDPOT-UPVVNVLGSA-N
Instrument Name	Varian 450-240
Ionization Type	EI
Literature Reference DOI	10.1021/acs.jnatprod.6b00189
Molecular Weight	182.281 g/mol
SMILES	N1[C@]2(CC[C@@]1(C(=CCC2)C(CC([D])([D])[D])=O)[H])[H]
SPLASH	splash10-0f89-3900000000-b24a7b3bd6f8b3b4ba1c
Source of Spectrum	G4-79-SM11-SM11-1
Wiley ID	1849379