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Methyl 5-ethyl-4-heptyl-3-hydroxy-2'-nitrobiphenyl-2-carboxylate
SpectraBase Compound ID JN7Edh99i9m
InChI InChI=1S/C23H29NO5/c1-4-6-7-8-9-12-17-16(5-2)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 WHDXZSMDBNBZKI-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 7i8DMC1YoHg
Name Methyl 5-ethyl-4-heptyl-3-hydroxy-2'-nitrobiphenyl-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H29NO5
InChI InChI=1S/C23H29NO5/c1-4-6-7-8-9-12-17-16(5-2)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 WHDXZSMDBNBZKI-UHFFFAOYSA-N
Molecular Weight 399.487 g/mol
SMILES Oc1c(c(-c2c(N(=O)=O)cccc2)cc(c1CCCCCCC)CC)C(=O)OC
SPLASH splash10-000b-1393000000-587210706b572a4c155b
Source of Spectrum F-65-9305-6i
Wiley ID 1678980