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(1S,2RS,4R,5S)-2-Ethyl-4-methyl-3,8-dioxabicyclo[3.2.1]octan-2-ol
SpectraBase Compound ID CRzai6x6UuG
InChI InChI=1S/C9H16O3/c1-3-9-5-4-7(12-9)8(10)11-6(9)2/h6-8,10H,3-5H2,1-2H3/t6-,7-,8+,9+/m1/s1
InChIKey JUHFQHGJZVWROU-HXFLIBJXSA-N
Mol Weight 172.22 g/mol
Molecular Formula C9H16O3
Exact Mass 172.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F26LIlXgZ8n
Name (1S,2RS,4R,5S)-2-Ethyl-4-methyl-3,8-dioxabicyclo[3.2.1]octan-2-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H16O3
InChI InChI=1S/C9H16O3/c1-3-9-5-4-7(12-9)8(10)11-6(9)2/h6-8,10H,3-5H2,1-2H3/t6-,7-,8+,9+/m1/s1
InChIKey JUHFQHGJZVWROU-HXFLIBJXSA-N
Molecular Weight 172.224 g/mol
SMILES O[C@@]1([C@@]2(O[C@]([C@](O1)(C)[H])(CC2)CC)[H])[H]
SPLASH splash10-05fs-9200000000-09fc699da6e34e0ec34a
Source of Spectrum F-49-5992-29
Synonyms (1S,2S,4R,5S)-2-Ethyl-4-methyl-3,8-dioxabicyclo[3.2.1]octan-2-ol 2,5-anhydro-3,4,7-trideoxy-1-C-ethyl-D-arabino-heptoseptanose
Wiley ID 1168826