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4-Azatricyclo[5.2.1.0[2,6]]decane-3,5-dione, 4-[4-(2-methylphenoxy)phenyl]-
SpectraBase Compound ID 2vc0XhwuNQ5
InChI InChI=1S/C22H21NO3/c1-13-4-2-3-5-18(13)26-17-10-8-16(9-11-17)23-21(24)19-14-6-7-15(12-14)20(19)22(23)25/h2-5,8-11,14-15,19-20H,6-7,12H2,1H3
InChIKey RXQLTHXVGBGSQG-UHFFFAOYSA-N
Mol Weight 347.41 g/mol
Molecular Formula C22H21NO3
Exact Mass 347.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 43TVVKnY8uM
Name 4-Azatricyclo[5.2.1.0[2,6]]decane-3,5-dione, 4-[4-(2-methylphenoxy)phenyl]-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H21NO3
InChI InChI=1S/C22H21NO3/c1-13-4-2-3-5-18(13)26-17-10-8-16(9-11-17)23-21(24)19-14-6-7-15(12-14)20(19)22(23)25/h2-5,8-11,14-15,19-20H,6-7,12H2,1H3
InChIKey RXQLTHXVGBGSQG-UHFFFAOYSA-N
Molecular Weight 347.414 g/mol
SMILES c1ccc(Oc2ccc(N3C(C4C5CCC(C4C3=O)C5)=O)cc2)c(C)c1
SPLASH splash10-0002-1119000000-975c3a5743fbfb9e59ae
Source of Spectrum AD-0-2532-0
Synonyms 4-[4-(2-methylphenoxy)phenyl]-4-azatricyclo[5.2.1.0(2,6)]decane-3,5-dione
Wiley ID 1422152