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2-(2-Adamantan-1-yl-2-oxo-ethyl)-3-amino-4-formyl-cyclopent-3-ene-1,1,2-tricarbonitrile
SpectraBase Compound ID HyOr8bodG6b
InChI InChI=1S/C21H22N4O2/c22-10-20(11-23)7-16(9-26)18(25)21(20,12-24)8-17(27)19-4-13-1-14(5-19)3-15(2-13)6-19/h9,13-15H,1-8,25H2
InChIKey UREBJGVXXWXYDI-UHFFFAOYSA-N
Mol Weight 362.43 g/mol
Molecular Formula C21H22N4O2
Exact Mass 362.174276 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GCwndwS1IEn
Name 2-(2-Adamantan-1-yl-2-oxo-ethyl)-3-amino-4-formyl-cyclopent-3-ene-1,1,2-tricarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H22N4O2
InChI InChI=1S/C21H22N4O2/c22-10-20(11-23)7-16(9-26)18(25)21(20,12-24)8-17(27)19-4-13-1-14(5-19)3-15(2-13)6-19/h9,13-15H,1-8,25H2
InChIKey UREBJGVXXWXYDI-UHFFFAOYSA-N
Molecular Weight 362.433 g/mol
SMILES NC=1C(C(CC1C=O)(C#N)C#N)(CC(C12CC3CC(C2)CC(C1)C3)=O)C#N
SPLASH splash10-002r-8900000000-767261b0c3a244f8e2e5
Synonyms 2-[2-(1-adamantyl)-2-keto-ethyl]-3-amino-4-formyl-cyclopent-3-ene-1,1,2-tricarbonitrile 2-[2-(1-adamantyl)-2-oxidanylidene-ethyl]-3-azanyl-4-methanoyl-cyclopent-3-ene-1,1,2-tricarbonitrile 2-[2-(1-adamantyl)-2-oxo-ethyl]-3-amino-4-formyl-cyclopent-3-ene-1,1,2-tricarbonitrile 2-[2-(1-Adamantyl)-2-oxoethyl]-3-amino-4-formyl-3-cyclopentene-1,1,2-tricarbonitrile
Wiley ID 1458313