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Isodihydrohistrionicotoxin 285a

View entire compound with spectra: 2 MS (GC)

Isodihydrohistrionicotoxin 285a
SpectraBase Compound ID GwNEyUTllP0
InChI InChI=1S/C19H27NO/c1-3-5-7-10-16-11-8-14-19(20-16)15-9-13-18(21)17(19)12-6-4-2/h2,5-6,12,16-18,20-21H,1,7-11,13-15H2/b12-6-
InChIKey FQVXLUMKQROGDW-SDQBBNPISA-N
Mol Weight 285.43 g/mol
Molecular Formula C19H27NO
Exact Mass 285.209264 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 69AcrdkzEjq
Name Isodihydrohistrionicotoxin 285a
CAS Registry Number 34272-52-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H27NO
InChI InChI=1S/C19H27NO/c1-3-5-7-10-16-11-8-14-19(20-16)15-9-13-18(21)17(19)12-6-4-2/h2,5-6,12,16-18,20-21H,1,7-11,13-15H2/b12-6-
InChIKey FQVXLUMKQROGDW-SDQBBNPISA-N
Molecular Weight 285.431 g/mol
SMILES OC1CCCC2(CCCC(CCC=C=C)N2)C1\C=C/C#C
SPLASH splash10-052b-3910000000-eec1a1fd4d7449c02146
Source of Spectrum X2-68-1556-1575
Wiley ID 1610170