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6-Cycloheptene-1,3,5-triol, (1.alpha.,3.alpha.,5.alpha.)-
SpectraBase Compound ID LTGwCcc00si
InChI InChI=1S/C7H12O3/c8-5-1-2-6(9)4-7(10)3-5/h1-2,5-10H,3-4H2/t5-,6+,7-
InChIKey LYALFCMGHRCAHP-KVSKUHBBSA-N
Mol Weight 144.17 g/mol
Molecular Formula C7H12O3
Exact Mass 144.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E7OaTna7tlS
Name 6-Cycloheptene-1,3,5-triol, (1.alpha.,3.alpha.,5.alpha.)-
Alternate Name(s) (1.alpha.,3.alpha.,5.alpha.)-6-cycloheptene-1,3,5-triol (1R,5S)-6-cycloheptene-1,3,5-triol
CAS Registry Number 121289-68-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H12O3
InChI InChI=1S/C7H12O3/c8-5-1-2-6(9)4-7(10)3-5/h1-2,5-10H,3-4H2/t5-,6+,7-
InChIKey LYALFCMGHRCAHP-KVSKUHBBSA-N
Molecular Weight 144.170 g/mol
SMILES O[C@]1(C[C@](C[C@](C=C1)(O)[H])(O)[H])[H]
SPLASH splash10-0a4i-0900000000-2de29d7c5a24f3749ee4
Source of Spectrum K-122-2185-4
Wiley ID 1142451