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Methyl 5-ethyl-4-hexyl-3-hydroxy-6-methyl-2'-nitrobiphenyl-2-carboxylate
SpectraBase Compound ID KxDuXjIUm2r
InChI InChI=1S/C23H29NO5/c1-5-7-8-9-12-17-16(6-2)15(3)20(21(22(17)25)23(26)29-4)18-13-10-11-14-19(18)24(27)28/h10-11,13-14,25H,5-9,12H2,1-4H3
InChIKey BZFSTWVCPVKADE-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 BTILCzH3vm6
Name Methyl 5-ethyl-4-hexyl-3-hydroxy-6-methyl-2'-nitrobiphenyl-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H29NO5
InChI InChI=1S/C23H29NO5/c1-5-7-8-9-12-17-16(6-2)15(3)20(21(22(17)25)23(26)29-4)18-13-10-11-14-19(18)24(27)28/h10-11,13-14,25H,5-9,12H2,1-4H3
InChIKey BZFSTWVCPVKADE-UHFFFAOYSA-N
Molecular Weight 399.487 g/mol
SMILES Oc1c(c(c(C)c(c1CCCCCC)CC)-c1c(N(=O)=O)cccc1)C(=O)OC
SPLASH splash10-000j-0297000000-912f1fde9efaa76a716e
Source of Spectrum F-65-9307-6r
Wiley ID 1678971