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(4-Adamantan-1-ylpiperazin-1-yl)(4-methyl-3-nitrophenyl)methanone
SpectraBase Compound ID GGryehou7ua
InChI InChI=1S/C22H29N3O3/c1-15-2-3-19(11-20(15)25(27)28)21(26)23-4-6-24(7-5-23)22-12-16-8-17(13-22)10-18(9-16)14-22/h2-3,11,16-18H,4-10,12-14H2,1H3
InChIKey MLHOTBNSDYBFSA-UHFFFAOYSA-N
Mol Weight 383.49 g/mol
Molecular Formula C22H29N3O3
Exact Mass 383.220892 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1py1tzEIWpP
Name (4-Adamantan-1-ylpiperazin-1-yl)(4-methyl-3-nitrophenyl)methanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H29N3O3
InChI InChI=1S/C22H29N3O3/c1-15-2-3-19(11-20(15)25(27)28)21(26)23-4-6-24(7-5-23)22-12-16-8-17(13-22)10-18(9-16)14-22/h2-3,11,16-18H,4-10,12-14H2,1H3
InChIKey MLHOTBNSDYBFSA-UHFFFAOYSA-N
Molecular Weight 383.492 g/mol
SMILES C12(N3CCN(CC3)C(c3ccc(c(N(=O)=O)c3)C)=O)CC3CC(C2)CC(C1)C3
SPLASH splash10-004r-2901000000-758b6e01680dc15f2dcf
Synonyms [4-(1-adamantyl)-1-piperazinyl]-(4-methyl-3-nitrophenyl)methanone [4-(1-adamantyl)piperazin-1-yl]-(4-methyl-3-nitro-phenyl)methanone [4-(1-adamantyl)piperazino]-(4-methyl-3-nitro-phenyl)methanone
Wiley ID 1441506