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4-(6b,7,8,9,10,10a-Hexahydrofluoranthen-(1 and 3)-yl)-4-oxobutyric acid
SpectraBase Compound ID 5yFn7finc2D
InChI InChI=1S/C20H20O3/c21-17(10-11-18(22)23)16-9-8-12-4-3-7-14-13-5-1-2-6-15(13)20(16)19(12)14/h3-4,7-9,13,15H,1-2,5-6,10-11H2,(H,22,23)
InChIKey PAZWFXPFVGHGRG-UHFFFAOYSA-N
Mol Weight 308.38 g/mol
Molecular Formula C20H20O3
Exact Mass 308.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1RbUmmL2GFJ
Name 4-(6b,7,8,9,10,10a-Hexahydrofluoranthen-(1 and 3)-yl)-4-oxobutyric acid
CAS Registry Number 77060-94-7
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20O3
InChI InChI=1S/C20H20O3/c21-17(10-11-18(22)23)16-9-8-12-4-3-7-14-13-5-1-2-6-15(13)20(16)19(12)14/h3-4,7-9,13,15H,1-2,5-6,10-11H2,(H,22,23)
InChIKey PAZWFXPFVGHGRG-UHFFFAOYSA-N
Molecular Weight 308.377 g/mol
SMILES OC(CCC(c1c2c3c(cccc3cc1)C1C2CCCC1)=O)=O
SPLASH splash10-000i-0093000000-c87ef361d4480f6b9f4e
Source of Spectrum J-46-2576-0
Synonyms 4-(6b,7,8,9,10,10a-hexahydro-1-fluoranthenyl)-4-oxobutanoic acid
Wiley ID 1310187