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1,2-Pyridazinedicarboxylic acid, 4,4'-[thiobis(3-isopropenyltrimethylene)]bis[5-chloro-3,6-dihydro-, tetraethyl ester
SpectraBase Compound ID 5FAs5f1NuzV
InChI InChI=1S/C32H48Cl2N4O8S/c1-9-43-29(39)35-17-23(25(33)19-37(35)31(41)45-11-3)13-15-27(21(5)6)47-28(22(7)8)16-14-24-18-36(30(40)44-10-2)38(20-26(24)34)32(42)46-12-4/h27-28H,5,7,9-20H2,1-4,6,8H3
InChIKey OBINCUKSAFROBZ-UHFFFAOYSA-N
Mol Weight 719.7 g/mol
Molecular Formula C32H48Cl2N4O8S
Exact Mass 718.256991 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IsWnogf0XsO
Name 1,2-Pyridazinedicarboxylic acid, 4,4'-[thiobis(3-isopropenyltrimethylene)]bis[5-chloro-3,6-dihydro-, tetraethyl ester
CAS Registry Number 27959-98-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H48Cl2N4O8S
InChI InChI=1S/C32H48Cl2N4O8S/c1-9-43-29(39)35-17-23(25(33)19-37(35)31(41)45-11-3)13-15-27(21(5)6)47-28(22(7)8)16-14-24-18-36(30(40)44-10-2)38(20-26(24)34)32(42)46-12-4/h27-28H,5,7,9-20H2,1-4,6,8H3
InChIKey OBINCUKSAFROBZ-UHFFFAOYSA-N
Molecular Weight 719.722 g/mol
SMILES C(N1N(CC(=C(C1)CCC(SC(C(=C)C)CCC=1CN(C(=O)OCC)N(CC1Cl)C(=O)OCC)C(=C)C)Cl)C(=O)OCC)(=O)OCC
SPLASH splash10-05mo-9830000000-84c52bcf4bfc982126ec
Source of Spectrum AJ-43-545-2
Synonyms 1,2-Pyridazinedicarboxylic acid, 4,4'-[thiobis(3-isopropenyltrimethylene)]bis@5-chloro-3,6-dihydro-, tetraethyl ester 3-(1-(5'-chloro-1',2'-diethoxycarbonyl-3',6'-dihydropyridazin-4'-yl)4-methylene)pentyl sulfide Diethyl 4-chloro-5-{3-[(1-{2-[5-chloro-1,2-bis(ethoxycarbonyl)-1,2,3,6-tetrahydro-4-pyridazinyl]ethyl}-2-methyl-2-propenyl)sulfanyl]-4-methyl-4-pentenyl}-3,6-dihydro-1,2-pyridazinedicarboxylate
Wiley ID 1415572