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6,7-Bis(3-hydroxypropyl)-1,3,5,8-tetramethyl-2,4-divinylporphyrin
SpectraBase Compound ID EsUnbpBohe0
InChI InChI=1S/C34H38N4O2/c1-7-23-19(3)27-15-28-21(5)25(11-9-13-39)33(37-28)18-34-26(12-10-14-40)22(6)30(38-34)17-32-24(8-2)20(4)29(36-32)16-31(23)35-27/h7-8,15-18,35,38-40H,1-2,9-14H2,3-6H3/b27-15-,28-15-,29-16-,30-17-,31-16-,32-17-,33-18-,34-18-
InChIKey XALLIUOIWHHGMC-MFBGAUBSSA-N
Mol Weight 534.7 g/mol
Molecular Formula C34H38N4O2
Exact Mass 534.299476 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AfViNAxfw4d
Name 6,7-Bis(3-hydroxypropyl)-1,3,5,8-tetramethyl-2,4-divinylporphyrin
CAS Registry Number 76915-39-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H38N4O2
InChI InChI=1S/C34H38N4O2/c1-7-23-19(3)27-15-28-21(5)25(11-9-13-39)33(37-28)18-34-26(12-10-14-40)22(6)30(38-34)17-32-24(8-2)20(4)29(36-32)16-31(23)35-27/h7-8,15-18,35,38-40H,1-2,9-14H2,3-6H3/b27-15-,28-15-,29-16-,30-17-,31-16-,32-17-,33-18-,34-18-
InChIKey XALLIUOIWHHGMC-MFBGAUBSSA-N
Molecular Weight 534.704 g/mol
SMILES [nH]1c2cc3nc(cc4c(c(c(cc5c(CCCO)c(c(cc1c(c2C=C)C)n5)C)[nH]4)CCCO)C)c(c3C)C=C
SPLASH splash10-001u-0005190000-f1c6b37d66901913a199
Source of Spectrum J-46-2191-0
Synonyms 3-[20-(3-hydroxypropyl)-5,10,15,19-tetramethyl-9,14-divinyl-21,22,23,24-tetraazapentacyclo[16.2.1.1(3,6).1(8,11).1(13,16)]tetracosa-1,3,5,7,9,11(23),12,14,16,18(21),19-undecaen-4-yl]-1-propanol
Wiley ID 1403884