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29-Iodo-1,14,33-triaza-17,20,23-trioxatricyclo[12.11.7.1(27,31)]tritriaconta-27(33),28,30-triene-2,13-dione
SpectraBase Compound ID IYuMsYXQBVK
InChI InChI=1S/C27H42IN3O5/c28-23-19-24-21-30-11-13-34-15-17-36-18-16-35-14-12-31(22-25(20-23)29-24)27(33)10-8-6-4-2-1-3-5-7-9-26(30)32/h19-20H,1-18,21-22H2
InChIKey MUAIJAPLPXULBD-UHFFFAOYSA-N
Mol Weight 615.6 g/mol
Molecular Formula C27H42IN3O5
Exact Mass 615.216916 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B62Sy8qSvU5
Name 29-Iodo-1,14,33-triaza-17,20,23-trioxatricyclo[12.11.7.1(27,31)]tritriaconta-27(33),28,30-triene-2,13-dione
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Formula C27H42IN3O5
InChI InChI=1S/C27H42IN3O5/c28-23-19-24-21-30-11-13-34-15-17-36-18-16-35-14-12-31(22-25(20-23)29-24)27(33)10-8-6-4-2-1-3-5-7-9-26(30)32/h19-20H,1-18,21-22H2
InChIKey MUAIJAPLPXULBD-UHFFFAOYSA-N
Molecular Weight 615.553 g/mol
SMILES C1(N2CCOCCOCCOCCN(C(CCCCCCCCCC1)=O)Cc1cc(cc(C2)n1)I)=O
SPLASH splash10-014i-0010209000-d053fb19dfa3e5978b0e
Source of Spectrum U1-2002-3683-1
Synonyms 29-iodo-17,20,23-trioxa-1,14,33-triazatricyclo[12.11.7.1(27,31)]tritriaconta-27(33),28,30-triene-2,13-dione
Wiley ID 1523380