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1,3-Bis(methoxycarbonyl)-5-cyano-5-methyl-1-[(2-cyanoisopropyl)cyclohexadienyl]hexa-1,3-diene
SpectraBase Compound ID IxEbFHTdHEE
InChI InChI=1S/C22H26N2O4/c1-21(2,13-23)12-15(19(25)27-5)11-17(20(26)28-6)16-9-7-8-10-18(16)22(3,4)14-24/h8,10-12H,7,9H2,1-6H3/b15-12-,17-11+
InChIKey LPMKNAKKKQAFGT-ITCLVUFISA-N
Mol Weight 382.46 g/mol
Molecular Formula C22H26N2O4
Exact Mass 382.189257 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H6kk6xTcOXf
Name 1,3-Bis(methoxycarbonyl)-5-cyano-5-methyl-1-[(2-cyanoisopropyl)cyclohexadienyl]hexa-1,3-diene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H26N2O4
InChI InChI=1S/C22H26N2O4/c1-21(2,13-23)12-15(19(25)27-5)11-17(20(26)28-6)16-9-7-8-10-18(16)22(3,4)14-24/h8,10-12H,7,9H2,1-6H3/b15-12-,17-11+
InChIKey LPMKNAKKKQAFGT-ITCLVUFISA-N
Molecular Weight 382.460 g/mol
SMILES C1(\C(=C/C(=C/C(C#N)(C)C)C(=O)OC)C(=O)OC)=C(C(C#N)(C)C)C=CCC1
SPLASH splash10-0f89-0092000000-f7346f69ab7aac062172
Source of Spectrum F-53-7934-21
Synonyms Dimethyl (2E,4Z)-2-[2-(1-cyano-1-methylethyl)-1,3-cyclohexadien-1-yl]-4-(2-cyano-2-methylpropylidene)-2-pentenedioate
Wiley ID 802509