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11-Methylene-13-methyl-9-(phenylsulfonyl)-1,9-diazatricyclo[10.8.1.0(14,19)]eicosane-14,16,18-trien-20-one
SpectraBase Compound ID DQmFL2gDoY0
InChI InChI=1S/C26H32N2O3S/c1-21-19-26(2)23-15-9-10-16-24(23)28(25(26)29)18-12-5-3-4-11-17-27(20-21)32(30,31)22-13-7-6-8-14-22/h6-10,13-16H,1,3-5,11-12,17-20H2,2H3
InChIKey JZSUHXQQEKHDGJ-UHFFFAOYSA-N
Mol Weight 452.6 g/mol
Molecular Formula C26H32N2O3S
Exact Mass 452.213364 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1UO7hPafQdn
Name 11-Methylene-13-methyl-9-(phenylsulfonyl)-1,9-diazatricyclo[10.8.1.0(14,19)]eicosane-14,16,18-trien-20-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H32N2O3S
InChI InChI=1S/C26H32N2O3S/c1-21-19-26(2)23-15-9-10-16-24(23)28(25(26)29)18-12-5-3-4-11-17-27(20-21)32(30,31)22-13-7-6-8-14-22/h6-10,13-16H,1,3-5,11-12,17-20H2,2H3
InChIKey JZSUHXQQEKHDGJ-UHFFFAOYSA-N
Molecular Weight 452.613 g/mol
SMILES C1N(S(=O)(=O)c2ccccc2)CCCCCCCN2C(C(CC1=C)(c1c2cccc1)C)=O
SPLASH splash10-03di-0009000000-e0366473335874117044
Source of Spectrum F-56-7550-23
Wiley ID 858695