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Myricanene A

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Myricanene A
SpectraBase Compound ID 9MgqMj6fGTa
InChI InChI=1S/C21H24O4/c1-24-20-17-13-15(19(23)21(20)25-2)9-7-5-3-4-6-8-14-10-11-18(22)16(17)12-14/h3-4,10-13,22-23H,5-9H2,1-2H3/b4-3+
InChIKey DERKWAJDBPHDET-ONEGZZNKSA-N
Mol Weight 340.42 g/mol
Molecular Formula C21H24O4
Exact Mass 340.167459 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DIZovkivqdX
Name Myricanene A
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H24O4
InChI InChI=1S/C21H24O4/c1-24-20-17-13-15(19(23)21(20)25-2)9-7-5-3-4-6-8-14-10-11-18(22)16(17)12-14/h3-4,10-13,22-23H,5-9H2,1-2H3/b4-3+
InChIKey DERKWAJDBPHDET-ONEGZZNKSA-N
Molecular Weight 340.419 g/mol
SMILES Oc1c2-c3cc(c(c(c3OC)OC)O)CCC\C=C\CCc(cc1)c2
SPLASH splash10-0006-0009000000-a5168f6246170f454730
Source of Spectrum E2-50-213-2
Wiley ID 1555796