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Kelevan
SpectraBase Compound ID FetlPyv9pzd
InChI InChI=1S/C17H12Cl10O4/c1-2-31-7(29)4-3-6(28)5-8(30)9(18)11(20)13(22)10(8,19)14(23)12(9,21)15(11,24)17(26,27)16(13,14)25/h30H,2-5H2,1H3
InChIKey POSKOXIJDWDKPH-UHFFFAOYSA-N
Mol Weight 634.8 g/mol
Molecular Formula C17H12Cl10O4
Exact Mass 629.762086 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dv67kE79NTA
Name 1,3,4-Metheno-1H-cyclobuta[cd]pentalene-2-pentanoic acid, 1,1a,3,3a,4,5,5,5a,5b,6-decachlorooctahydro-2-hydroxy-.gamma.-oxo-, ethyl ester
CAS Registry Number 4234-79-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H12Cl10O4
InChI InChI=1S/C17H12Cl10O4/c1-2-31-7(29)4-3-6(28)5-8(30)9(18)11(20)13(22)10(8,19)14(23)12(9,21)15(11,24)17(26,27)16(13,14)25/h30H,2-5H2,1H3
InChIKey POSKOXIJDWDKPH-UHFFFAOYSA-N
Molecular Weight 634.809 g/mol
SMILES OC1(CC(CCC(OCC)=O)=O)C2(C3(C4(C1(C1(C2(C3(C(C41Cl)(Cl)Cl)Cl)Cl)Cl)Cl)Cl)Cl)Cl
SPLASH splash10-0udi-5941010000-2bfe5acae0f9cba7c8fc
Source of Spectrum W6-39057-26479-0
Synonyms 1,3,4-Methano-1H-cyclobuta(cd)pentalene-2-pentanoic acid, 1,1a,3,3a,4,5,5,5a,5b,6-decachlorooctahydro-2-hydroxy-gamma-oxo-, ethyl ester 1,3,4-Metheno-1H-cyclobuta(c,d)-pentalene-2-levulinic acid, 1,1a,3,3a,4,5,5a,5b,6-decachlorooctahydro-2-hydroxy-, ethyl ester 1,3,4-Metheno-1H-cyclobuta[cd]pentalene-2-levulinic acid, 1,1a,3,3a,4,5,5,5a,5b,6-decachlorooctahydro-2-hydroxy-, ethyl ester Despirol Ethyl 1,1a,3,3a,4,5,5a,5b,6-decachlorooctahydro-2-hydroxy-1,3,4-metheno-2H-cyclobuta(cd) pentamethylene-2-levulinate Kelevan AI3-27154 Allied GC 9160 CASWELL NO. 436C GC 9160 General Chemical 9160 General Chemicals 9160
Wiley ID 127918