For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
3,15,21-Triaza-4,5;13,14-dibenzo-6,12-dioxa-9-thiabicyclo[15.3.1]heneicosa-1(21),17,19-triene-2,16-dione
SpectraBase Compound ID 3uOvJKO3Q7O
InChI InChI=1S/C23H21N3O4S/c27-22-18-8-5-9-19(24-18)23(28)26-17-7-2-4-11-21(17)30-13-15-31-14-12-29-20-10-3-1-6-16(20)25-22/h1-11H,12-15H2,(H,25,27)(H,26,28)
InChIKey NBMCAYSSDPRBCG-UHFFFAOYSA-N
Mol Weight 435.5 g/mol
Molecular Formula C23H21N3O4S
Exact Mass 435.125277 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 4WyIywAcI9I
Name 3,15,21-Triaza-4,5;13,14-dibenzo-6,12-dioxa-9-thiabicyclo[15.3.1]heneicosa-1(21),17,19-triene-2,16-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H21N3O4S
InChI InChI=1S/C23H21N3O4S/c27-22-18-8-5-9-19(24-18)23(28)26-17-7-2-4-11-21(17)30-13-15-31-14-12-29-20-10-3-1-6-16(20)25-22/h1-11H,12-15H2,(H,25,27)(H,26,28)
InChIKey NBMCAYSSDPRBCG-UHFFFAOYSA-N
Molecular Weight 435.498 g/mol
SMILES N1c2c(OCCSCCOc3c(NC(c4nc(C1=O)ccc4)=O)cccc3)cccc2
SPLASH splash10-000i-9340400000-39769530c378aec656a6
Source of Spectrum KC-57-6062-1
Wiley ID 1625091