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N-(p-methoxybenzyl)-11-methylene-8-azatricyclo[4.3.3.0(1,6)]dodec-3-en-7,9-dione
SpectraBase Compound ID 7ThIHcAbLYD
InChI InChI=1S/C20H21NO3/c1-14-11-19-9-3-4-10-20(19,12-14)18(23)21(17(19)22)13-15-5-7-16(24-2)8-6-15/h3-8H,1,9-13H2,2H3/t19-,20+
InChIKey NMMQJPBAVHZIMH-BGYRXZFFSA-N
Mol Weight 323.39 g/mol
Molecular Formula C20H21NO3
Exact Mass 323.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JHnXCUlTYup
Name N-(p-methoxybenzyl)-11-methylene-8-azatricyclo[4.3.3.0(1,6)]dodec-3-en-7,9-dione
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H21NO3
InChI InChI=1S/C20H21NO3/c1-14-11-19-9-3-4-10-20(19,12-14)18(23)21(17(19)22)13-15-5-7-16(24-2)8-6-15/h3-8H,1,9-13H2,2H3/t19-,20+
InChIKey NMMQJPBAVHZIMH-BGYRXZFFSA-N
Instrument Name Hewlett-Packard 5988A
Ionization Type EI
Literature Reference DOI 10.1021/ml500108s
Molecular Weight 323.392 g/mol
SMILES [C@@]123[C@@](CC=CC3)(C(N(C1=O)Cc1ccc(cc1)OC)=O)CC(C2)=C
SPLASH splash10-00di-0904000000-f6fe2d72be7fda76682d
Source of Spectrum MCS-5-SM13-16
Wiley ID 1864199