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(2S,3S)-3-Benzyloxy-1,2-heptandiol

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

(2S,3S)-3-Benzyloxy-1,2-heptandiol
SpectraBase Compound ID C1qpuOwUI1e
InChI InChI=1S/C14H22O3/c1-2-3-9-14(13(16)10-15)17-11-12-7-5-4-6-8-12/h4-8,13-16H,2-3,9-11H2,1H3/t13-,14-/m0/s1
InChIKey PLSBBAMLIRWFKU-KBPBESRZSA-N
Mol Weight 238.33 g/mol
Molecular Formula C14H22O3
Exact Mass 238.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2ftNFENQDUg
Name (2S,3S)-3-Benzyloxy-1,2-heptandiol
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O3
InChI InChI=1S/C14H22O3/c1-2-3-9-14(13(16)10-15)17-11-12-7-5-4-6-8-12/h4-8,13-16H,2-3,9-11H2,1H3/t13-,14-/m0/s1
InChIKey PLSBBAMLIRWFKU-KBPBESRZSA-N
Molecular Weight 238.327 g/mol
SMILES O[C@@](CO)([C@@](OCc1ccccc1)(CCCC)[H])[H]
SPLASH splash10-0006-9100000000-dca9f59da04ffff75e23
Source of Spectrum F-47-9338-6
Synonyms (2S,3S)-3-(benzyloxy)-1,2-heptanediol
Wiley ID 1240851