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2,4,5,6,7 alpha,7a alpha-hexahydro-7 beta-hydroxy-3-methyl-6 alpha-(4-methyl-3-pentenyl)-2-oxo-6 beta-benzofurancarboxylic acid, methyl ester

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2,4,5,6,7 alpha,7a alpha-hexahydro-7 beta-hydroxy-3-methyl-6 alpha-(4-methyl-3-pentenyl)-2-oxo-6 beta-benzofurancarboxylic acid, methyl ester
SpectraBase Compound ID BjBqdRRzm1Q
InChI InChI=1S/C17H24O5/c1-10(2)6-5-8-17(16(20)21-4)9-7-12-11(3)15(19)22-13(12)14(17)18/h6,13-14,18H,5,7-9H2,1-4H3/t13-,14-,17+/s2
InChIKey DJJNBZNYCRUWLH-CYQBEIBHSA-N
Mol Weight 308.37 g/mol
Molecular Formula C17H24O5
Exact Mass 308.162374 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID FVWtjPZ8gCi
Name 2,4,5,6,7alpha,7aalpha-HEXAHYDRO-7beta-HYDROXY-3-METHYL-6alpha-(4-METHYL-3-PENTENYL)-2-OXO-6beta-BENZOFURANCARBOXYLIC ACID, METHYL ESTER
Source of Sample A. Yoshikoshi, Tohoku University, Sendai, Japan
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H24O5
InChI InChI=1S/C17H24O5/c1-10(2)6-5-8-17(16(20)21-4)9-7-12-11(3)15(19)22-13(12)14(17)18/h6,13-14,18H,5,7-9H2,1-4H3/t13-,14-,17+/s2
InChIKey DJJNBZNYCRUWLH-CYQBEIBHSA-N
Literature Reference J. ORG. CHEM. 46, 4264(1981) Abstract-Chemical Abstracts= 95, 150926(1981)
Melting Point 163-164C
Molecular Weight 308.373993
Synonyms 6B-BENZOFURANCARBOXYLIC ACID, 2,4,5,- 6,7A,7AA-HEXAHYDRO-7B-HYDROXY-3-METHYL- 6A-/4-METHYL-3-PENTENYL/-2-OXO-, METHYL ESTER
Technique KBr WAFER