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4-(cis-2,3,4,Trans-6-tetramethyl-3-cyclohexenyl)-trans-3-buten-2-one 2,4-dinitrophenylhydrazone
SpectraBase Compound ID 1baFS4wbunL
InChI InChI=1S/C20H26N4O4/c1-12-10-13(2)18(16(5)15(12)4)8-6-14(3)21-22-19-9-7-17(23(25)26)11-20(19)24(27)28/h6-9,11,13,16,18,22H,10H2,1-5H3/b8-6+,21-14-
InChIKey GJTVAHNZDLUFPN-JHUIMYODSA-N
Mol Weight 386.45 g/mol
Molecular Formula C20H26N4O4
Exact Mass 386.195405 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID BfoykRBJVvA
Name 4-(cis-2,3,4,Trans-6-tetramethyl-3-cyclohexenyl)-trans-3-buten-2-one 2,4-dinitrophenylhydrazone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 386.195405329 u
Formula C20H26N4O4
InChI InChI=1S/C20H26N4O4/c1-12-10-13(2)18(16(5)15(12)4)8-6-14(3)21-22-19-9-7-17(23(25)26)11-20(19)24(27)28/h6-9,11,13,16,18,22H,10H2,1-5H3/b8-6+,21-14-
InChIKey GJTVAHNZDLUFPN-JHUIMYODSA-N
Molecular Weight 386.452 g/mol
SMILES C1=C(C=C(C(=C1)N\N=C/(\C=C\C1C(CC(=C(C1C)C)C)C)C)N(=O)=O)N(=O)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.920652