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(2R,3R)-3-Propylheptane-1,2,3-triol (7f) and (2R,3S)-3-Propylheptane-l,2,3-triol (8f)
SpectraBase Compound ID X4qmWKH37h
InChI InChI=1S/C10H22O3/c1-3-5-7-10(13,6-4-2)9(12)8-11/h9,11-13H,3-8H2,1-2H3/t9-,10?/m1/s1
InChIKey BLKMMGLIGALMKF-YHMJZVADSA-N
Mol Weight 190.28 g/mol
Molecular Formula C10H22O3
Exact Mass 190.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID moAfro0WW
Name (2R,3R)-3-Propylheptane-1,2,3-triol (7f) and (2R,3S)-3-Propylheptane-l,2,3-triol (8f)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H22O3
InChI InChI=1S/C10H22O3/c1-3-5-7-10(13,6-4-2)9(12)8-11/h9,11-13H,3-8H2,1-2H3/t9-,10?/m1/s1
InChIKey BLKMMGLIGALMKF-YHMJZVADSA-N
Literature Reference DOI 10.1002/prac.19913330610
Molecular Weight 190.283 g/mol
SMILES OC[C@](C(O)(CCCC)CCC)(O)[H]
SPLASH splash10-016s-6900000000-03e5ab23b2020b4383f7
Source of Spectrum JF-333-885-7f+8f
Synonyms (2R)-3-propylheptane-1,2,3-triol
Wiley ID 1789701