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Methyl 3-hydroxy-5-methyl-2'-nitro-4-octylbiphenyl-2-carboxylate
SpectraBase Compound ID CFxuv4um9oq
InChI InChI=1S/C23H29NO5/c1-4-5-6-7-8-9-12-17-16(2)15-19(21(22(17)25)23(26)29-3)18-13-10-11-14-20(18)24(27)28/h10-11,13-15,25H,4-9,12H2,1-3H3
InChIKey FPMODWRWJUKYMN-UHFFFAOYSA-N
Mol Weight 399.49 g/mol
Molecular Formula C23H29NO5
Exact Mass 399.204573 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GLNZsmhWFud
Name Methyl 3-hydroxy-5-methyl-2'-nitro-4-octylbiphenyl-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H29NO5
InChI InChI=1S/C23H29NO5/c1-4-5-6-7-8-9-12-17-16(2)15-19(21(22(17)25)23(26)29-3)18-13-10-11-14-20(18)24(27)28/h10-11,13-15,25H,4-9,12H2,1-3H3
InChIKey FPMODWRWJUKYMN-UHFFFAOYSA-N
Molecular Weight 399.487 g/mol
SMILES Oc1c(c(-c2c(N(=O)=O)cccc2)cc(c1CCCCCCCC)C)C(=O)OC
SPLASH splash10-0lfs-0696100000-294479ba8652d4fab430
Source of Spectrum F-65-9305-6d
Wiley ID 1678985