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1H-Indene-1,3,4-triol, 6-(2-chloroethyl)-2,3-dihydro-2,2,5,7-tetramethyl-, (1R-cis)-
SpectraBase Compound ID 4H8k1bwPmsm
InChI InChI=1S/C15H21ClO3/c1-7-9(5-6-16)8(2)12(17)11-10(7)13(18)15(3,4)14(11)19/h13-14,17-19H,5-6H2,1-4H3/t13-,14+/m1/s1
InChIKey VQSCRMIYYGGVGW-KGLIPLIRSA-N
Mol Weight 284.78 g/mol
Molecular Formula C15H21ClO3
Exact Mass 284.117922 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9Kq1QPkrOIR
Name 1H-Indene-1,3,4-triol, 6-(2-chloroethyl)-2,3-dihydro-2,2,5,7-tetramethyl-, (1R-cis)-
CAS Registry Number 125392-73-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H21ClO3
InChI InChI=1S/C15H21ClO3/c1-7-9(5-6-16)8(2)12(17)11-10(7)13(18)15(3,4)14(11)19/h13-14,17-19H,5-6H2,1-4H3/t13-,14+/m1/s1
InChIKey VQSCRMIYYGGVGW-KGLIPLIRSA-N
Molecular Weight 284.783 g/mol
SMILES O[C@@]1(c2c(c(c(c(c2C)CCCl)C)O)[C@@](C1(C)C)(O)[H])[H]
SPLASH splash10-0gb9-0090000000-a845072bfab5f719f2d9
Source of Spectrum F-45-5438-5
Synonyms (1R,3R)-6-(2-chloroethyl)-2,2,5,7-tetramethyl-2,3-dihydro-1H-indene-1,3,4-triol cis-(1,3)-3-hydro-1,3,4-trihydro-6-(2-chloroethyl)-2,2,5,7-tetramethyl-3H-indene
Wiley ID 1287755