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Benzoic acid, 4-benzyloxy-2-hexyl-6-methoxy-
SpectraBase Compound ID 4Ot43dMBjTR
InChI InChI=1S/C21H26O4/c1-3-4-5-9-12-17-13-18(14-19(24-2)20(17)21(22)23)25-15-16-10-7-6-8-11-16/h6-8,10-11,13-14H,3-5,9,12,15H2,1-2H3,(H,22,23)
InChIKey YEHMVFPIBWJRCW-UHFFFAOYSA-N
Mol Weight 342.44 g/mol
Molecular Formula C21H26O4
Exact Mass 342.183109 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B32LOTYaMJk
Name Benzoic acid, 4-benzyloxy-2-hexyl-6-methoxy-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H26O4
InChI InChI=1S/C21H26O4/c1-3-4-5-9-12-17-13-18(14-19(24-2)20(17)21(22)23)25-15-16-10-7-6-8-11-16/h6-8,10-11,13-14H,3-5,9,12,15H2,1-2H3,(H,22,23)
InChIKey YEHMVFPIBWJRCW-UHFFFAOYSA-N
Molecular Weight 342.435 g/mol
SMILES OC(c1c(cc(OCc2ccccc2)cc1CCCCCC)OC)=O
SPLASH splash10-0006-9222000000-43cd1da868c0c8ea9f52
Synonyms 2-Hexyl-6-methoxy-4-phenylmethoxy-benzoic acid 4-Benzoxy-2-hexyl-6-methoxy-benzoic acid 4-Benzyloxy-2-hexyl-6-methoxy-benzoic acid
Wiley ID 1479407