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15-Chloroacetoxy-6,14,15,24,32,33-hexahydro-16H-tetrabenzo[b,h,p,v][1,7,18,24,4,11,14,21]tetraoxatetraazacycloheptacosin-7,23,30,35-(8H,22H,31H,34H)-tetraone
SpectraBase Compound ID 1hppYIkimuK
InChI InChI=1S/C37H35ClN4O10/c38-19-35(45)52-24-20-48-31-15-7-3-11-27(31)41-33(43)22-50-29-13-5-1-9-25(29)36(46)39-17-18-40-37(47)26-10-2-6-14-30(26)51-23-34(44)42-28-12-4-8-16-32(28)49-21-24/h1-16,24H,17-23H2,(H,39,46)(H,40,47)(H,41,43)(H,42,44)
InChIKey VSRFVHSTUFACOD-UHFFFAOYSA-N
Mol Weight 731.2 g/mol
Molecular Formula C37H35ClN4O10
Exact Mass 730.204171 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CgLlQ9XoPDu
Name 15-Chloroacetoxy-6,14,15,24,32,33-hexahydro-16H-tetrabenzo[b,h,p,v][1,7,18,24,4,11,14,21]tetraoxatetraazacycloheptacosin-7,23,30,35-(8H,22H,31H,34H)-tetraone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C37H35ClN4O10
InChI InChI=1S/C37H35ClN4O10/c38-19-35(45)52-24-20-48-31-15-7-3-11-27(31)41-33(43)22-50-29-13-5-1-9-25(29)36(46)39-17-18-40-37(47)26-10-2-6-14-30(26)51-23-34(44)42-28-12-4-8-16-32(28)49-21-24/h1-16,24H,17-23H2,(H,39,46)(H,40,47)(H,41,43)(H,42,44)
InChIKey VSRFVHSTUFACOD-UHFFFAOYSA-N
Molecular Weight 731.158 g/mol
SMILES N1CCNC(c2c(OCC(Nc3ccccc3OCC(OC(=O)CCl)COc3c(NC(COc4c(C1=O)cccc4)=O)cccc3)=O)cccc2)=O
SPLASH splash10-00kr-0195010000-05ab0806c32ab624b79e
Source of Spectrum C5-2004-425-19
Synonyms 15,22,27,34-tetraoxo-7,8,15,16,22,23,24,25,26,27,34,35-dodecahydro-6H,14H,33H-tetrabenzo[e,l,r,z][1,7,11,17,4,14,21,24]tetraoxatetraazacycloheptacosin-7-yl chloroacetate
Wiley ID 1616618