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2-Hydroxy-3-octyl-4-methoxy-6-(hydroxymethyl)benzoic Acid
SpectraBase Compound ID 8ISqutaGjsH
InChI InChI=1S/C17H26O5/c1-3-4-5-6-7-8-9-13-14(22-2)10-12(11-18)15(16(13)19)17(20)21/h10,18-19H,3-9,11H2,1-2H3,(H,20,21)
InChIKey MQAQAHZVPYRYQT-UHFFFAOYSA-N
Mol Weight 310.39 g/mol
Molecular Formula C17H26O5
Exact Mass 310.178024 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GVsNdmlw5C
Name 2-Hydroxy-3-octyl-4-methoxy-6-(hydroxymethyl)benzoic Acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H26O5
InChI InChI=1S/C17H26O5/c1-3-4-5-6-7-8-9-13-14(22-2)10-12(11-18)15(16(13)19)17(20)21/h10,18-19H,3-9,11H2,1-2H3,(H,20,21)
InChIKey MQAQAHZVPYRYQT-UHFFFAOYSA-N
Molecular Weight 310.390 g/mol
SMILES OCc1c(c(c(c(c1)OC)CCCCCCCC)O)C(=O)O
SPLASH splash10-03di-0194000000-b3c4dec34983bf9b4bbc
Source of Spectrum X2-48-921-3
Synonyms 2-Hydroxy-6-(hydroxymethyl)-4-methoxy-3-octylbenzoic acid
Wiley ID 1601751