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13-[(N-Piperidinyl)acetoxy]-6,12,13,20,28,29-hexahydro-14H-tetrabenzo[b,f,n,r]-[1,5,16,20,9,12]-tetraoxadiazatricosin-26,31-(27H,30H)-dione

View entire compound with spectra: 1 MS (GC)

13-[(N-Piperidinyl)acetoxy]-6,12,13,20,28,29-hexahydro-14H-tetrabenzo[b,f,n,r]-[1,5,16,20,9,12]-tetraoxadiazatricosin-26,31-(27H,30H)-dione
SpectraBase Compound ID CbBQfYrLGw6
InChI InChI=1S/C40H43N3O8/c44-38(24-43-22-10-1-11-23-43)51-31-27-49-34-16-6-2-12-29(34)25-47-36-18-8-4-14-32(36)39(45)41-20-21-42-40(46)33-15-5-9-19-37(33)48-26-30-13-3-7-17-35(30)50-28-31/h2-9,12-19,31H,1,10-11,20-28H2,(H,41,45)(H,42,46)
InChIKey HCRCGERPBAYXSA-UHFFFAOYSA-N
Mol Weight 693.8 g/mol
Molecular Formula C40H43N3O8
Exact Mass 693.305015 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K9wqPTSvO2G
Name 13-[(N-Piperidinyl)acetoxy]-6,12,13,20,28,29-hexahydro-14H-tetrabenzo[b,f,n,r]-[1,5,16,20,9,12]-tetraoxadiazatricosin-26,31-(27H,30H)-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C40H43N3O8
InChI InChI=1S/C40H43N3O8/c44-38(24-43-22-10-1-11-23-43)51-31-27-49-34-16-6-2-12-29(34)25-47-36-18-8-4-14-32(36)39(45)41-20-21-42-40(46)33-15-5-9-19-37(33)48-26-30-13-3-7-17-35(30)50-28-31/h2-9,12-19,31H,1,10-11,20-28H2,(H,41,45)(H,42,46)
InChIKey HCRCGERPBAYXSA-UHFFFAOYSA-N
Molecular Weight 693.797 g/mol
SMILES N1CCNC(c2c(OCc3ccccc3OCC(OC(CN3CCCCC3)=O)COc3c(COc4c(C1=O)cccc4)cccc3)cccc2)=O
SPLASH splash10-0uxs-0791000000-160ada9c8c67caa9f838
Source of Spectrum AJ-42-99-22
Wiley ID 1567777