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Porphyrin 1,2,3,4,,5,6,7,8-octamethyl ester
SpectraBase Compound ID FvO7lQ19sxv
InChI InChI=1S/C36H30N4O16/c1-49-29(41)21-13-9-15-23(31(43)51-3)25(33(45)53-5)17(38-15)11-19-27(35(47)55-7)28(36(48)56-8)20(40-19)12-18-26(34(46)54-6)24(32(44)52-4)16(39-18)10-14(37-13)22(21)30(42)50-2/h9-12,37,40H,1-8H3/b13-9-,14-10-,15-9-,16-10-,17-11-,18-12-,19-11-,20-12-
InChIKey ZLIHGZJFYAYBKC-CEVVSZFKSA-N
Mol Weight 774.6 g/mol
Molecular Formula C36H30N4O16
Exact Mass 774.165681 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9u0uRwqv0af
Name Porphyrin 1,2,3,4,,5,6,7,8-octamethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H30N4O16
InChI InChI=1S/C36H30N4O16/c1-49-29(41)21-13-9-15-23(31(43)51-3)25(33(45)53-5)17(38-15)11-19-27(35(47)55-7)28(36(48)56-8)20(40-19)12-18-26(34(46)54-6)24(32(44)52-4)16(39-18)10-14(37-13)22(21)30(42)50-2/h9-12,37,40H,1-8H3/b13-9-,14-10-,15-9-,16-10-,17-11-,18-12-,19-11-,20-12-
InChIKey ZLIHGZJFYAYBKC-CEVVSZFKSA-N
Molecular Weight 774.648 g/mol
SMILES [nH]1c2c(c(c1cc1c(c(c(cc3[nH]c(cc4c(c(c(c2)n4)C(=O)OC)C(=O)OC)c(c3C(=O)OC)C(=O)OC)n1)C(=O)OC)C(=O)OC)C(=O)OC)C(=O)OC
SPLASH splash10-0gb9-0951000000-fd906a2bf61017d0423e
Source of Spectrum J-57-6082-5
Wiley ID 1416772