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3-(Nonyloxy)-1,2,4-butanetriol
SpectraBase Compound ID ANG279UKPqH
InChI InChI=1S/C13H28O4/c1-2-3-4-5-6-7-8-9-17-13(11-15)12(16)10-14/h12-16H,2-11H2,1H3/t12-,13-/m0/s1
InChIKey WFPADRQPGVVYJX-STQMWFEESA-N
Mol Weight 248.36 g/mol
Molecular Formula C13H28O4
Exact Mass 248.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C7PkwdJwlII
Name 3-(Nonyloxy)-1,2,4-butanetriol
CAS Registry Number 163776-15-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H28O4
InChI InChI=1S/C13H28O4/c1-2-3-4-5-6-7-8-9-17-13(11-15)12(16)10-14/h12-16H,2-11H2,1H3/t12-,13-/m0/s1
InChIKey WFPADRQPGVVYJX-STQMWFEESA-N
Molecular Weight 248.363 g/mol
SMILES OC[C@@]([C@](CO)(O)[H])(OCCCCCCCCC)[H]
SPLASH splash10-0596-9000000000-aa998cd28bd48d57caea
Synonyms 3-nonoxybutane-1,2,4-triol l-Threitol, 2-O-nonyl-
Wiley ID 1501283