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2-Cyanoacetoxy-2-cyanomethyl-N,N'-dicyclohexylmalondiamide
SpectraBase Compound ID Ey2vYtKt7f1
InChI InChI=1S/C20H28N4O4/c21-13-11-17(25)28-20(12-14-22,18(26)23-15-7-3-1-4-8-15)19(27)24-16-9-5-2-6-10-16/h15-16H,1-12H2,(H,23,26)(H,24,27)
InChIKey ROOCQLCWKQGDDL-UHFFFAOYSA-N
Mol Weight 388.47 g/mol
Molecular Formula C20H28N4O4
Exact Mass 388.211055 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LmLGGgEB3FI
Name 2-Cyanoacetoxy-2-cyanomethyl-N,N'-dicyclohexylmalondiamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H28N4O4
InChI InChI=1S/C20H28N4O4/c21-13-11-17(25)28-20(12-14-22,18(26)23-15-7-3-1-4-8-15)19(27)24-16-9-5-2-6-10-16/h15-16H,1-12H2,(H,23,26)(H,24,27)
InChIKey ROOCQLCWKQGDDL-UHFFFAOYSA-N
Molecular Weight 388.468 g/mol
SMILES N(C(C(C(NC1CCCCC1)=O)(OC(CC#N)=O)CC#N)=O)C1CCCCC1
SPLASH splash10-01ot-4901000000-dd29c96b0966c4b4eaef
Source of Spectrum CV-0-465-3
Synonyms 1-(cyanomethyl)-2-(cyclohexylamino)-1-[(cyclohexylamino)carbonyl]-2-oxoethyl cyanoacetate 2-cyanoacetic acid[1-(cyanomethyl)-2-(cyclohexylamino)-1-(cyclohexylcarbamoyl)-2-keto-ethyl]ester 2-cyanoacetic acid[2-(cyanomethyl)-1,3-bis(cyclohexylamino)-1,3-dioxopropan-2-yl]ester [1-(cyanomethyl)-2-(cyclohexylamino)-1-(cyclohexylcarbamoyl)-2-oxo-ethyl]2-cyanoacetate [2-(cyanomethyl)-1,3-bis(cyclohexylamino)-1,3-bis(oxidanylidene)propan-2-yl]2-cyanoethanoate [2-(cyanomethyl)-1,3-bis(cyclohexylamino)-1,3-dioxopropan-2-yl]2-cyanoacetate 2-cyanoacetic acid [2-(cyanomethyl)-1,3-bis(cyclohexylamino)-1,3-dioxopropan-2-yl] ester [2-(cyanomethyl)-1,3-bis(cyclohexylamino)-1,3-dioxopropan-2-yl] 2-cyanoacetate [1-(cyanomethyl)-2-(cyclohexylamino)-1-(cyclohexylcarbamoyl)-2-oxo-ethyl] 2-cyanoacetate [2-(cyanomethyl)-1,3-bis(cyclohexylamino)-1,3-bis(oxidanylidene)propan-2-yl] 2-cyanoethanoate
Wiley ID 849144