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Dimethyl 4-(benzylamino)-2-(3,5-dimethyl-4-isoxazolyl)-6-methyl-3,5-cyclohexadiene-1,3-dicarboxylate
SpectraBase Compound ID Lws0r0ubZAC
InChI InChI=1S/C23H26N2O5/c1-13-11-17(24-12-16-9-7-6-8-10-16)20(23(27)29-5)21(18(13)22(26)28-4)19-14(2)25-30-15(19)3/h6-11,18,21,24H,12H2,1-5H3
InChIKey NBTGTQAHFOYEBF-UHFFFAOYSA-N
Mol Weight 410.47 g/mol
Molecular Formula C23H26N2O5
Exact Mass 410.184172 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 67KQfNc9vHu
Name Dimethyl 4-(benzylamino)-2-(3,5-dimethyl-4-isoxazolyl)-6-methyl-3,5-cyclohexadiene-1,3-dicarboxylate
CAS Registry Number 107378-04-1
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H26N2O5
InChI InChI=1S/C23H26N2O5/c1-13-11-17(24-12-16-9-7-6-8-10-16)20(23(27)29-5)21(18(13)22(26)28-4)19-14(2)25-30-15(19)3/h6-11,18,21,24H,12H2,1-5H3
InChIKey NBTGTQAHFOYEBF-UHFFFAOYSA-N
Molecular Weight 410.470 g/mol
SMILES N(Cc1ccccc1)C=1C=C(C)C(C(c2c(C)noc2C)C1C(=O)OC)C(=O)OC
SPLASH splash10-0006-9004100000-24c6a9626eaa53f46e2e
Source of Spectrum Y-23-713-3
Synonyms 2-(3,5-dimethyl-4-isoxazolyl)-6-methyl-4-[(phenylmethyl)amino]cyclohexa-3,5-diene-1,3-dicarboxylic acid dimethyl ester 3,5-Dimethyl-4-[2,6-bis(methoxycarbonyl)-3-benzylamino-5-methylcyclohexa-2,4-dienyl]isoxazole 4-(benzylamino)-2-(3,5-dimethylisoxazol-4-yl)-6-methyl-cyclohexa-3,5-diene-1,3-dicarboxylic acid dimethyl ester Dimethyl 2-(3,5-dimethyl-1,2-oxazol-4-yl)-6-methyl-4-[(phenylmethyl)amino]cyclohexa-3,5-diene-1,3-dicarboxylate Dimethyl 4-(benzylamino)-2-(3,5-dimethyl-1,2-oxazol-4-yl)-6-methylcyclohexa-3,5-diene-1,3-dicarboxylate Dimethyl 4-(benzylamino)-2-(3,5-dimethylisoxazol-4-yl)-6-methyl-cyclohexa-3,5-diene-1,3-dicarboxylate
Wiley ID 1373673