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Cyclopentaneoctanoic acid, 5-(acetyloxy)-.epsilon.,3-bis(methoxyimino)-2-(3-methoxy-3-oxopropyl)-, methyl ester, [1R-(1.alpha.,2.beta.,5.beta.)-
SpectraBase Compound ID EDPTTYBappm
InChI InChI=1S/C22H36N2O8/c1-15(25)32-20-14-19(24-31-5)17(12-13-22(27)29-3)18(20)11-10-16(23-30-4)8-6-7-9-21(26)28-2/h17-18,20H,6-14H2,1-5H3/b23-16+,24-19+
InChIKey NQOKBKAVPIAWKR-FXSINEHXSA-N
Mol Weight 456.5 g/mol
Molecular Formula C22H36N2O8
Exact Mass 456.247166 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J48rrs4Kt4m
Name Cyclopentaneoctanoic acid, 5-(acetyloxy)-.epsilon.,3-bis(methoxyimino)-2-(3-methoxy-3-oxopropyl)-, methyl ester, [1R-(1.alpha.,2.beta.,5.beta.)-
CAS Registry Number 55669-97-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H36N2O8
InChI InChI=1S/C22H36N2O8/c1-15(25)32-20-14-19(24-31-5)17(12-13-22(27)29-3)18(20)11-10-16(23-30-4)8-6-7-9-21(26)28-2/h17-18,20H,6-14H2,1-5H3/b23-16+,24-19+
InChIKey NQOKBKAVPIAWKR-FXSINEHXSA-N
Molecular Weight 456.536 g/mol
SMILES CO\N=C/(CCCCC(=O)OC)CCC1C(C\C(=N/OC)C1CCC(=O)OC)OC(C)=O
SPLASH splash10-014i-0349200000-1021025a2cc40119b309
Source of Spectrum C-91-2178-1
Synonyms (6E)-8-[(3E)-5-acetoxy-2-(3-keto-3-methoxy-propyl)-3-methyloximino-cyclopentyl]-6-methyloximino-caprylic acid methyl ester (6E)-8-[(3E)-5-acetyloxy-3-methoxyimino-2-(3-methoxy-3-oxopropyl)cyclopentyl]-6-methoxyiminooctanoic acid methyl ester Cyclopentaneoctanoic acid, 5-(acetyloxy)-.epsilon.,3-bis(methoxyimino)-2-(3-methoxy-3-oxopropyl)-, methyl ester, (1.alpha.,2.beta.,5.beta.)- Methyl (6E)-8-[(3E)-5-acetoxy-3-methoxyimino-2-(3-methoxy-3-oxo-propyl)cyclopentyl]-6-methoxyimino-octanoate Methyl (6E)-8-[(3E)-5-acetyloxy-3-methoxyimino-2-(3-methoxy-3-oxidanylidene-propyl)cyclopentyl]-6-methoxyimino-octanoate Methyl (6E)-8-[(3E)-5-acetyloxy-3-methoxyimino-2-(3-methoxy-3-oxopropyl)cyclopentyl]-6-methoxyiminooctanoate
Wiley ID 1389211