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Spiro[s-indacene-2(1H),2'-[2H]indene]-4-carboxylic acid, 5'-acetyl-1',3,3',5,6,7-hexahydro-
SpectraBase Compound ID CqaO23DFgUs
InChI InChI=1S/C23H22O3/c1-13(24)14-5-6-16-9-23(10-17(16)7-14)11-18-8-15-3-2-4-19(15)21(22(25)26)20(18)12-23/h5-8H,2-4,9-12H2,1H3,(H,25,26)
InChIKey JCJMWXVAWIPLTB-UHFFFAOYSA-N
Mol Weight 346.43 g/mol
Molecular Formula C23H22O3
Exact Mass 346.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JbBngIFjfY2
Name Spiro[s-indacene-2(1H),2'-[2H]indene]-4-carboxylic acid, 5'-acetyl-1',3,3',5,6,7-hexahydro-
CAS Registry Number 125868-45-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H22O3
InChI InChI=1S/C23H22O3/c1-13(24)14-5-6-16-9-23(10-17(16)7-14)11-18-8-15-3-2-4-19(15)21(22(25)26)20(18)12-23/h5-8H,2-4,9-12H2,1H3,(H,25,26)
InChIKey JCJMWXVAWIPLTB-UHFFFAOYSA-N
Molecular Weight 346.426 g/mol
SMILES OC(c1c2c(cc3CCCc13)CC1(C2)Cc2cc(C(=O)C)ccc2C1)=O
SPLASH splash10-004i-9000000000-f0a9bc5d8ba1a18a2a1c
Source of Spectrum AH-120-640-36
Synonyms 5'-acetylspiro[2,3,5,7-tetrahydro-1H-s-indacene-6,2'-indane]-4-carboxylic acid 5-Acetyl-4'-spiro[1,3-dihydroindene-2,6'-2,3,5,7-tetrahydro-1H-s-indacene]carboxylic acid 5-Acetylspiro[1,3-dihydroindene-2,6'-2,3,5,7-tetrahydro-1H-s-indacene]-4'-carboxylic acid 5-Ethanoylspiro[1,3-dihydroindene-2,6'-2,3,5,7-tetrahydro-1H-s-indacene]-4'-carboxylic acid
Wiley ID 1339701