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2,3,7,8,12,13,17,18-Octaethyl-N(21),N(24) : N(22), N(23)-dipropano-porphyrinogen
SpectraBase Compound ID qgUfLCjdOK
InChI InChI=1S/C42H60N4/c1-9-27-31(13-5)39-25-40-33(15-7)29(11-3)37-24-38-30(12-4)34(16-8)42(46(38)22-18-21-45(37)40)26-41-32(14-6)28(10-2)36-23-35(27)43(39)19-17-20-44(36)41/h9-26H2,1-8H3
InChIKey NFVORZSXJFZVAR-UHFFFAOYSA-N
Mol Weight 621.0 g/mol
Molecular Formula C42H60N4
Exact Mass 620.481798 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9TAWoustRp8
Name 2,3,7,8,12,13,17,18-Octaethyl-N(21),N(24) : N(22), N(23)-dipropano-porphyrinogen
Alternate Name(s) 2,3,7,8,16,17,21,22-octaethyl-10,14,24,28-tetraazaheptacyclo[21.5.1.1(9,15).0(4,28).0(6,10).0(14,18).0(20,24)]triaconta-1,3,6,8,15,17,20,22-octaene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C42H60N4
InChI InChI=1S/C42H60N4/c1-9-27-31(13-5)39-25-40-33(15-7)29(11-3)37-24-38-30(12-4)34(16-8)42(46(38)22-18-21-45(37)40)26-41-32(14-6)28(10-2)36-23-35(27)43(39)19-17-20-44(36)41/h9-26H2,1-8H3
InChIKey NFVORZSXJFZVAR-UHFFFAOYSA-N
Molecular Weight 620.970 g/mol
SMILES c12[n]3c(Cc4[n]5c(Cc6[n](c(Cc7[n](c(C2)c(c7CC)CC)CCC3)c(c6CC)CC)CCC5)c(c4CC)CC)c(c1CC)CC
SPLASH splash10-03k9-0902007000-1446a4d6420f6de42b0c
Source of Spectrum U-1993-1079-14
Wiley ID 765367