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ARTEMISIN
SpectraBase Compound ID 2aqofhYUxjz
InChI InChI=1S/C15H22O5/c1-8-4-5-11-9(2)12(16)17-13-15(11)10(8)6-7-14(3,18-13)19-20-15/h8-11,13H,4-7H2,1-3H3/t8-,9-,10+,11+,13-,14-,15-/m1/s1
InChIKey BLUAFEHZUWYNDE-NNWCWBAJSA-N
Mol Weight 282.34 g/mol
Molecular Formula C15H22O5
Exact Mass 282.146724 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GxEzYA582qx
Name Artemisinin
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22O5
InChI InChI=1S/C15H22O5/c1-8-4-5-11-9(2)12(16)17-13-15(11)10(8)6-7-14(3,18-13)19-20-15/h8-11,13H,4-7H2,1-3H3/t8-,9-,10+,11+,13-,14-,15-/m1/s1
InChIKey BLUAFEHZUWYNDE-NNWCWBAJSA-N
Literature Reference DOI 10.1002/pca.2800020507
Molecular Weight 282.336 g/mol
SMILES C1[C@@]2(O[C@@]3([C@]4([C@@](C1)([C@@](CC[C@]4([C@](C(O3)=O)(C)[H])[H])(C)[H])[H])OO2)[H])C
SPLASH splash10-052f-9200000000-9abd3a726f3722e9d073
Source of Spectrum PA-2-216-3
Synonyms (3R,5aS,6R,8aS,9R,12S,12aR)-3,6,9-trimethyloctahydro-12H-3,12-epoxy[1,2]dioxepino[4,3-i]isochromen-10(3H)-one
Wiley ID 1800142