Tetraethyl 2,7,12,17-tetramethyl-21H,23H-porphine-3,8,13,18-tetrapropionate tin(iy) dichloride

SpectraBase Compound ID	JEYvjhls1G6
InChI	InChI=1S/C44H52N4O8.2ClH.Sn/c1-9-53-41(49)17-13-29-25(5)33-21-34-26(6)31(15-19-43(51)55-11-3)39(46-34)24-40-32(16-20-44(52)56-12-4)28(8)36(48-40)23-38-30(14-18-42(50)54-10-2)27(7)35(47-38)22-37(29)45-33;;;/h21-24H,9-20H2,1-8H3;2*1H;/q-2;;;+4/p-2/b33-21-,34-21-,35-22-,36-23-,37-22-,38-23-,39-24-,40-24-;;;
InChIKey	KFDHGDOOBKISNC-NFMZFZDYSA-L Google Search
Mol Weight	954.5 g/mol
Molecular Formula	C44H52Cl2N4O8Sn
Exact Mass	954.218422 g/mol

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SpectraBase Spectrum ID	HE4rVLPHeRG
Name	Tetraethyl 2,7,12,17-tetramethyl-21H,23H-porphine-3,8,13,18-tetrapropionate tin(iy) dichloride
Comments	Computed using HOSE algorithm
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	954.218422042 u
Formula	C44H52Cl2N4O8Sn
InChI	InChI=1S/C44H52N4O8.2ClH.Sn/c1-9-53-41(49)17-13-29-25(5)33-21-34-26(6)31(15-19-43(51)55-11-3)39(46-34)24-40-32(16-20-44(52)56-12-4)28(8)36(48-40)23-38-30(14-18-42(50)54-10-2)27(7)35(47-38)22-37(29)45-33;;;/h21-24H,9-20H2,1-8H3;2*1H;/q-2;;;+4/p-2/b33-21-,34-21-,35-22-,36-23-,37-22-,38-23-,39-24-,40-24-;;;
InChIKey	KFDHGDOOBKISNC-NFMZFZDYSA-L
Molecular Weight	954.537 g/mol
SMILES	C=12N3C(=CC4=NC(=CC=5N([Sn]3(Cl)Cl)C(C=C3N=C(C1)C(=C3CCC(OCC)=O)C)=C(C5CCC(OCC)=O)C)C(=C4C)CCC(=O)OCC)C(=C2CCC(OCC)=O)C