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8-(2'-Hydroxy-5'-methylbenzyl)-5,6,7,8,9,10,11,12-octahydro-2H-1,15,4,8,12-benzodioxatriazacycloheptadecine-3,13(4H,14H)-dione

View entire compound with spectra: 1 MS (GC)

8-(2'-Hydroxy-5'-methylbenzyl)-5,6,7,8,9,10,11,12-octahydro-2H-1,15,4,8,12-benzodioxatriazacycloheptadecine-3,13(4H,14H)-dione
SpectraBase Compound ID DdWa8ibqjwp
InChI InChI=1S/C24H31N3O5/c1-18-8-9-20(28)19(14-18)15-27-12-4-10-25-23(29)16-31-21-6-2-3-7-22(21)32-17-24(30)26-11-5-13-27/h2-3,6-9,14,28H,4-5,10-13,15-17H2,1H3,(H,25,29)(H,26,30)
InChIKey YLTTZVYLSGTHFD-UHFFFAOYSA-N
Mol Weight 441.53 g/mol
Molecular Formula C24H31N3O5
Exact Mass 441.226371 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Iz1WrVRfJPC
Name 8-(2'-Hydroxy-5'-methylbenzyl)-5,6,7,8,9,10,11,12-octahydro-2H-1,15,4,8,12-benzodioxatriazacycloheptadecine-3,13(4H,14H)-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H31N3O5
InChI InChI=1S/C24H31N3O5/c1-18-8-9-20(28)19(14-18)15-27-12-4-10-25-23(29)16-31-21-6-2-3-7-22(21)32-17-24(30)26-11-5-13-27/h2-3,6-9,14,28H,4-5,10-13,15-17H2,1H3,(H,25,29)(H,26,30)
InChIKey YLTTZVYLSGTHFD-UHFFFAOYSA-N
Molecular Weight 441.528 g/mol
SMILES N1CCCN(Cc2c(ccc(c2)C)O)CCCNC(=O)COc2ccccc2OCC1=O
SPLASH splash10-05gj-9300000000-9696676936dad7ee9366
Source of Spectrum I-86-431-7
Wiley ID 1691581