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4-[[16-(4-hydroxy-3,5-dimethoxy-benzyl)-1,4,10,13-tetraoxa-7,16-diazacyclooctadec-7-yl]methyl]-2,6-dimethoxy-phenol
SpectraBase Compound ID 6rfjjkZMymb
InChI InChI=1S/C30H46N2O10/c1-35-25-17-23(18-26(36-2)29(25)33)21-31-5-9-39-13-15-41-11-7-32(8-12-42-16-14-40-10-6-31)22-24-19-27(37-3)30(34)28(20-24)38-4/h17-20,33-34H,5-16,21-22H2,1-4H3
InChIKey IVBPYHBWQIAARR-UHFFFAOYSA-N
Mol Weight 594.7 g/mol
Molecular Formula C30H46N2O10
Exact Mass 594.315246 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9nJBDPLS7lH
Name 4-[[16-(4-hydroxy-3,5-dimethoxy-benzyl)-1,4,10,13-tetraoxa-7,16-diazacyclooctadec-7-yl]methyl]-2,6-dimethoxy-phenol
Comments Less than 3 mono-isotopic peaks
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Formula C30H46N2O10
InChI InChI=1S/C30H46N2O10/c1-35-25-17-23(18-26(36-2)29(25)33)21-31-5-9-39-13-15-41-11-7-32(8-12-42-16-14-40-10-6-31)22-24-19-27(37-3)30(34)28(20-24)38-4/h17-20,33-34H,5-16,21-22H2,1-4H3
InChIKey IVBPYHBWQIAARR-UHFFFAOYSA-N
Molecular Weight 594.702 g/mol
SMILES Oc1c(cc(CN2CCOCCOCCN(Cc3cc(c(c(c3)OC)O)OC)CCOCCOCC2)cc1OC)OC
SPLASH splash10-004i-0000900000-990558c3cb62d0485ad9
Source of Spectrum Y-38-589-13
Synonyms 4-[[16-[(3,5-dimethoxy-4-oxidanyl-phenyl)methyl]-1,4,10,13-tetraoxa-7,16-diazacyclooctadec-7-yl]methyl]-2,6-dimethoxy-phenol 4-[[16-[(4-hydroxy-3,5-dimethoxy-phenyl)methyl]-1,4,10,13-tetraoxa-7,16-diazacyclooctadec-7-yl]methyl]-2,6-dimethoxy-phenol
Wiley ID 848380