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2-(CYCLOHEXYLAMINO)-6,6-DIMETHYL-3-(4-NITROPHENYL)-6,7-DIHYDRO-1-BENZOFURAN-4-(5-H)-ONE
SpectraBase Compound ID H3rQ0RhXZoh
InChI InChI=1S/C22H26N2O4/c1-22(2)12-17(25)20-18(13-22)28-21(23-15-6-4-3-5-7-15)19(20)14-8-10-16(11-9-14)24(26)27/h8-11,15,23H,3-7,12-13H2,1-2H3
InChIKey YRGBBPHWVSDGHT-UHFFFAOYSA-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 77UdokiArmC
Name 2-(Cyclohexylamino)-6,7-dihydro-6,6-dimethyl-3-(4-nitrophenyl)benzofuran-4(5H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H26N2O4
InChI InChI=1S/C22H26N2O4/c1-22(2)12-17(25)20-18(13-22)28-21(23-15-6-4-3-5-7-15)19(20)14-8-10-16(11-9-14)24(26)27/h8-11,15,23H,3-7,12-13H2,1-2H3
InChIKey YRGBBPHWVSDGHT-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hlca.201000029
Molecular Weight 382.460 g/mol
SMILES N(C1CCCCC1)c1c(-c2ccc(cc2)[N+](=O)[O-])c2c(CC(C)(C)CC2=O)o1
SPLASH splash10-001i-9631000000-ffe89464248864325ab4
Source of Spectrum H-93-2193-4f
Synonyms 2-(cyclohexylamino)-6,6-dimethyl-3-(4-nitrophenyl)-6,7-dihydrobenzofuran-4(5H)-one
Wiley ID 1783907