Debug Info

object
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_id
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CN9ZNF5qaOZ
spectrumID
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CN9ZNF5qaOZ
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131072
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MS (GC)
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Mass Spectrum (GC)
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Diethyl 2-acetoxy-6-[2-(2-hydroxyethoxy)ethoxy]azulene-1,3-dicarboxylate
SpectraBase Compound ID C4on5tfV5gv
InChI InChI=1S/C22H26O9/c1-4-28-21(25)18-16-8-6-15(30-13-12-27-11-10-23)7-9-17(16)19(22(26)29-5-2)20(18)31-14(3)24/h6-9,23H,4-5,10-13H2,1-3H3
InChIKey YMLGNYCLZYWYOE-UHFFFAOYSA-N
Mol Weight 434.44 g/mol
Molecular Formula C22H26O9
Exact Mass 434.157682 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CN9ZNF5qaOZ
Name Diethyl 2-acetoxy-6-[2-(2-hydroxyethoxy)ethoxy]azulene-1,3-dicarboxylate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H26O9
InChI InChI=1S/C22H26O9/c1-4-28-21(25)18-16-8-6-15(30-13-12-27-11-10-23)7-9-17(16)19(22(26)29-5-2)20(18)31-14(3)24/h6-9,23H,4-5,10-13H2,1-3H3
InChIKey YMLGNYCLZYWYOE-UHFFFAOYSA-N
Molecular Weight 434.441 g/mol
SMILES OCCOCCOc1ccc2c(cc1)c(c(c2C(=O)OCC)OC(=O)C)C(=O)OCC
SPLASH splash10-0005-0009200000-ad22de39f489f21466aa
Source of Spectrum QA-41-201-9
Synonyms Diethyl 2-(acetyloxy)-6-[2-(2-hydroxyethoxy)ethoxy]-1,3-azulenedicarboxylate
Wiley ID 861813
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