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Triethyl Cyclopenta[cd]azulene-1,1,4(2H)-tricarboxylate
SpectraBase Compound ID 9AmgqgeaDza
InChI InChI=1S/C21H22O6/c1-4-25-18(22)15-11-13-12-21(19(23)26-5-2,20(24)27-6-3)16-10-8-7-9-14(15)17(13)16/h7-11H,4-6,12H2,1-3H3
InChIKey RODOKFXEVBTBEI-UHFFFAOYSA-N
Mol Weight 370.4 g/mol
Molecular Formula C21H22O6
Exact Mass 370.141638 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DU6XHaxn22t
Name Triethyl Cyclopenta[cd]azulene-1,1,4(2H)-tricarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H22O6
InChI InChI=1S/C21H22O6/c1-4-25-18(22)15-11-13-12-21(19(23)26-5-2,20(24)27-6-3)16-10-8-7-9-14(15)17(13)16/h7-11H,4-6,12H2,1-3H3
InChIKey RODOKFXEVBTBEI-UHFFFAOYSA-N
Molecular Weight 370.401 g/mol
SMILES c1ccc2C(Cc3c2c(c(C(OCC)=O)c3)c1)(C(OCC)=O)C(OCC)=O
SPLASH splash10-0umj-0492000000-8fb1419b013c4f801ff6
Source of Spectrum H-97-514-6d
Wiley ID 1784932