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(3R,7S)-8-hydroxy-3,7-dimethyl-caprylic acid methyl ester
SpectraBase Compound ID 7Pb8TImIZkp
InChI InChI=1S/C11H22O3/c1-9(7-11(13)14-3)5-4-6-10(2)8-12/h9-10,12H,4-8H2,1-3H3/t9-,10+/m1/s1
InChIKey RAMVTICSOAUWAU-ZJUUUORDSA-N
Mol Weight 202.29 g/mol
Molecular Formula C11H22O3
Exact Mass 202.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9VLsN3LiJ5V
Name (3R,7S)-8-hydroxy-3,7-dimethyl-caprylic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H22O3
InChI InChI=1S/C11H22O3/c1-9(7-11(13)14-3)5-4-6-10(2)8-12/h9-10,12H,4-8H2,1-3H3/t9-,10+/m1/s1
InChIKey RAMVTICSOAUWAU-ZJUUUORDSA-N
Molecular Weight 202.294 g/mol
SMILES OC[C@](CCC[C@](CC(=O)OC)(C)[H])(C)[H]
SPLASH splash10-0uk9-7900000000-50543003fb1705888086
Source of Spectrum J-62-1539-5
Synonyms (3R,7S)-8-hydroxy-3,7-dimethyloctanoic acid methyl ester Methyl (3R,7S)-3,7-dimethyl-8-oxidanyl-octanoate Methyl (3R,7S)-8-hydroxy-3,7-dimethyl-octanoate
Wiley ID 1199763