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3,6,9,12,15,18,21-Heptaoxa-27-azabicyclo[21.3.1]heptacosa-1(27),23,25-triene-2,22-dithione
SpectraBase Compound ID 5BO041FphKV
InChI InChI=1S/C19H27NO7S2/c28-18-16-2-1-3-17(20-16)19(29)27-15-13-25-11-9-23-7-5-21-4-6-22-8-10-24-12-14-26-18/h1-3H,4-15H2
InChIKey ICYONYRZWXFDGU-UHFFFAOYSA-N
Mol Weight 445.55 g/mol
Molecular Formula C19H27NO7S2
Exact Mass 445.122895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HPIyuA8Clfo
Name 3,6,9,12,15,18,21-Heptaoxa-27-azabicyclo[21.3.1]heptacosa-1(27),23,25-triene-2,22-dithione
CAS Registry Number 86309-71-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H27NO7S2
InChI InChI=1S/C19H27NO7S2/c28-18-16-2-1-3-17(20-16)19(29)27-15-13-25-11-9-23-7-5-21-4-6-22-8-10-24-12-14-26-18/h1-3H,4-15H2
InChIKey ICYONYRZWXFDGU-UHFFFAOYSA-N
Molecular Weight 445.545 g/mol
SMILES c12nc(C(OCCOCCOCCOCCOCCOCCOC2=S)=S)ccc1
SPLASH splash10-00di-2910000000-cb5db62d8a8d09e9482b
Source of Spectrum J-48-2638-0
Wiley ID 1386300