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Ethyl 2-(Isobutylamino)-6-phenyl-4-styrylcyclohexa-1,3-dienecarboxylate

View entire compound with spectra: 1 MS (GC)

Ethyl 2-(Isobutylamino)-6-phenyl-4-styrylcyclohexa-1,3-dienecarboxylate
SpectraBase Compound ID 5b1f2ojyeB7
InChI InChI=1S/C27H31NO2/c1-4-30-27(29)26-24(23-13-9-6-10-14-23)17-22(18-25(26)28-19-20(2)3)16-15-21-11-7-5-8-12-21/h5-16,18,20,24,28H,4,17,19H2,1-3H3/b16-15+
InChIKey MQKNKBHYHVKDOF-FOCLMDBBSA-N
Mol Weight 401.55 g/mol
Molecular Formula C27H31NO2
Exact Mass 401.235479 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4eMqxHX7Lc
Name Ethyl 2-(Isobutylamino)-6-phenyl-4-styrylcyclohexa-1,3-dienecarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H31NO2
InChI InChI=1S/C27H31NO2/c1-4-30-27(29)26-24(23-13-9-6-10-14-23)17-22(18-25(26)28-19-20(2)3)16-15-21-11-7-5-8-12-21/h5-16,18,20,24,28H,4,17,19H2,1-3H3/b16-15+
InChIKey MQKNKBHYHVKDOF-FOCLMDBBSA-N
Molecular Weight 401.550 g/mol
SMILES N(C1=C(C(CC(\C=C\c2ccccc2)=C1)c1ccccc1)C(=O)OCC)CC(C)C
SPLASH splash10-0zi4-7139700000-099ad5901650d3af9331
Source of Spectrum F4-43-3494-3d
Wiley ID 1690612