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Methyl 3-Cyano-5-heptyl-6-hydroxy-2-methylbenzoate
SpectraBase Compound ID 4fEefF1D9qZ
InChI InChI=1S/C17H23NO3/c1-4-5-6-7-8-9-13-10-14(11-18)12(2)15(16(13)19)17(20)21-3/h10,19H,4-9H2,1-3H3
InChIKey HKNRVRXSMLRESS-UHFFFAOYSA-N
Mol Weight 289.38 g/mol
Molecular Formula C17H23NO3
Exact Mass 289.167794 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 79lHlbbHk9F
Name Methyl 3-Cyano-5-heptyl-6-hydroxy-2-methylbenzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H23NO3
InChI InChI=1S/C17H23NO3/c1-4-5-6-7-8-9-13-10-14(11-18)12(2)15(16(13)19)17(20)21-3/h10,19H,4-9H2,1-3H3
InChIKey HKNRVRXSMLRESS-UHFFFAOYSA-N
Molecular Weight 289.375 g/mol
SMILES Oc1c(c(c(C#N)cc1CCCCCCC)C)C(=O)OC
SPLASH splash10-00dr-1960000000-181640c7698ca50f9cd7
Source of Spectrum F4-41-1627-4g
Wiley ID 1672338