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(1R,2S,1'R)-1-Acetoxy-2-[1'-hydroxyethyl]indane
SpectraBase Compound ID HZbOYvgtvaB
InChI InChI=1S/C13H16O3/c1-8(14)12-7-10-5-3-4-6-11(10)13(12)16-9(2)15/h3-6,8,12-14H,7H2,1-2H3/t8-,12+,13+/m1/s1
InChIKey QNRQJIFMTVQTIH-JCOFBHIZSA-N
Mol Weight 220.27 g/mol
Molecular Formula C13H16O3
Exact Mass 220.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 89C0ktSNKIV
Name (1R,2S,1'R)-1-Acetoxy-2-[1'-hydroxyethyl]indane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O3
InChI InChI=1S/C13H16O3/c1-8(14)12-7-10-5-3-4-6-11(10)13(12)16-9(2)15/h3-6,8,12-14H,7H2,1-2H3/t8-,12+,13+/m1/s1
InChIKey QNRQJIFMTVQTIH-JCOFBHIZSA-N
Molecular Weight 220.268 g/mol
SMILES O[C@@]([C@]1([C@](c2c(cccc2)C1)(OC(=O)C)[H])[H])(C)[H]
SPLASH splash10-014j-0900000000-adcd400143f144915b42
Source of Spectrum H-86-602-11
Synonyms (1R)-1-Acetoxy-2-[1'-hydroxyethyl]indane (1R,2S)-2-[(1R)-1-hydroxyethyl]-2,3-dihydro-1H-inden-1-yl acetate
Wiley ID 1525338