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2,3,7,8,12,13,17,18-Octaethyl-N(21),N(24) : N(22), N(23)-dipentano-porphyrinogen
SpectraBase Compound ID C9mBm1nYkI2
InChI InChI=1S/C46H68N4/c1-9-31-35(13-5)43-29-44-37(15-7)33(11-3)41-28-42-34(12-4)38(16-8)46(50(42)26-22-18-21-25-49(41)44)30-45-36(14-6)32(10-2)40-27-39(31)47(43)23-19-17-20-24-48(40)45/h9-30H2,1-8H3
InChIKey DHPRSQAPTXWQFT-UHFFFAOYSA-N
Mol Weight 677.1 g/mol
Molecular Formula C46H68N4
Exact Mass 676.544398 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 26iH84m31mP
Name 2,3,7,8,12,13,17,18-Octaethyl-N(21),N(24) : N(22), N(23)-dipentano-porphyrinogen
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C46H68N4
InChI InChI=1S/C46H68N4/c1-9-31-35(13-5)43-29-44-37(15-7)33(11-3)41-28-42-34(12-4)38(16-8)46(50(42)26-22-18-21-25-49(41)44)30-45-36(14-6)32(10-2)40-27-39(31)47(43)23-19-17-20-24-48(40)45/h9-30H2,1-8H3
InChIKey DHPRSQAPTXWQFT-UHFFFAOYSA-N
Molecular Weight 677.078 g/mol
SMILES c12[n]3c(Cc4[n]5c(Cc6[n](c(Cc7[n](c(C2)c(c7CC)CC)CCCCC3)c(c6CC)CC)CCCCC5)c(c4CC)CC)c(c1CC)CC
SPLASH splash10-004i-0900000000-53aada5dd3e09297b54c
Source of Spectrum U-1993-1079-17
Synonyms 2,3,7,8,18,19,23,24-octaethyl-10,16,26,32-tetraazaheptacyclo[23.7.1.1(9,17).0(4,32).0(6,10).0(16,20).0(22,26)]tetratriaconta-1,3,6,8,17,19,22,24-octaene
Wiley ID 765364