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CALIX-[4]-PYRROLE

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CALIX-[4]-PYRROLE
SpectraBase Compound ID IPN6glBWSoi
InChI InChI=1S/C28H36N4/c1-25(2)17-9-11-19(29-17)26(3,4)21-13-15-23(31-21)28(7,8)24-16-14-22(32-24)27(5,6)20-12-10-18(25)30-20/h9-16,29-32H,1-8H3
InChIKey XZCHDFOYWDLFEY-UHFFFAOYSA-N
Mol Weight 428.6 g/mol
Molecular Formula C28H36N4
Exact Mass 428.293997 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EJaDGGR3mdQ
Name 21H,23H-Porphine, 5,10,15,20,22,24-hexahydro-5,5,10,10,15,15,20,20-octamethyl-
CAS Registry Number 4475-42-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H36N4
InChI InChI=1S/C28H36N4/c1-25(2)17-9-11-19(29-17)26(3,4)21-13-15-23(31-21)28(7,8)24-16-14-22(32-24)27(5,6)20-12-10-18(25)30-20/h9-16,29-32H,1-8H3
InChIKey XZCHDFOYWDLFEY-UHFFFAOYSA-N
Molecular Weight 428.624 g/mol
SMILES [nH]1c2C(c3ccc(C(c4ccc(C(c5ccc(C(c1cc2)(C)C)[nH]5)(C)C)[nH]4)(C)C)[nH]3)(C)C
SPLASH splash10-03fs-2952600000-117845b640f33f0e8731
Synonyms 5,5,10,10,15,15,20,20-octamethyl-21,22,23,24-tetrahydroporphine 5,5,10,10,15,15,20,20-octamethyl-21,22,23,24-tetrahydroporphyrin
Wiley ID 1486513