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(4S,5R)-3-methyl-5-[(1R)-(E)-1-methyl-3-pentyl-3-pentenyl]-2-oxo-4-oxazolidinecarboxylic acid
SpectraBase Compound ID 73aD1Ug2hcs
InChI InChI=1S/C11H17NO4/c1-4-5-6-7(2)9-8(10(13)14)12(3)11(15)16-9/h4-5,7-9H,6H2,1-3H3,(H,13,14)/b5-4+/t7-,8+,9-/m1/s1
InChIKey BGAUKFKTGVDRHY-UNISNWAASA-N
Mol Weight 227.26 g/mol
Molecular Formula C11H17NO4
Exact Mass 227.115758 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID KbxD1qCd11g
Name (4S,5R)-3-METHYL-5-[(1R)-(E)-1-METHYL-3-PENTENYL]-2-OXO-4-OXAZOLIDINECARBOXYLIC ACID
Source of Sample R. M. Wenger, Sandoz Ltd., Basel, Switzerland
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H17NO4
InChI InChI=1S/C11H17NO4/c1-4-5-6-7(2)9-8(10(13)14)12(3)11(15)16-9/h4-5,7-9H,6H2,1-3H3,(H,13,14)/b5-4+/t7-,8+,9-/m1/s1
InChIKey BGAUKFKTGVDRHY-UNISNWAASA-N
Literature Reference HELV. CHIM. ACTA 66, 2308(1983) Abstract-Chemical Abstracts= 100, 139566R(1984)
Melting Point 81-82C
Molecular Weight 227.259995
Optical Properties Optical Rotation= (22C) +33.5 DEG (c=1.0, CHLOROFORM)
Synonyms 4-OXAZOLIDINECARBOXYLIC ACID, 3-METHYL-5-//1R/-/E/-1-METHYL- 3-PENTENYL/-2-OXO-, /4S,5R/-,
Technique KBr WAFER