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2-[3-hydroxy-3-oxo-2-(5,6,7,8-tetrahydronaphthalen-2-ylmethyl)propyl]-5,6,7,8-tetrahydronaphthalene-1-carboxylic acid
SpectraBase Compound ID Cko802aSegI
InChI InChI=1S/C25H28O4/c26-24(27)21(14-16-9-10-17-5-1-2-7-19(17)13-16)15-20-12-11-18-6-3-4-8-22(18)23(20)25(28)29/h9-13,21H,1-8,14-15H2,(H,26,27)(H,28,29)
InChIKey AARDSHRCKCKLNM-UHFFFAOYSA-N
Mol Weight 392.5 g/mol
Molecular Formula C25H28O4
Exact Mass 392.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EG24Ew6kzlx
Name 2-[3-hydroxy-3-oxo-2-(5,6,7,8-tetrahydronaphthalen-2-ylmethyl)propyl]-5,6,7,8-tetrahydronaphthalene-1-carboxylic acid
CAS Registry Number 125868-64-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H28O4
InChI InChI=1S/C25H28O4/c26-24(27)21(14-16-9-10-17-5-1-2-7-19(17)13-16)15-20-12-11-18-6-3-4-8-22(18)23(20)25(28)29/h9-13,21H,1-8,14-15H2,(H,26,27)(H,28,29)
InChIKey AARDSHRCKCKLNM-UHFFFAOYSA-N
Molecular Weight 392.495 g/mol
SMILES OC(C(Cc1c(C(=O)O)c2c(cc1)CCCC2)Cc1cc2CCCCc2cc1)=O
SPLASH splash10-006t-0904000000-6cb30b77795a673afbbe
Source of Spectrum AH-120-618-28
Synonyms 2-[3-oxidanyl-3-oxidanylidene-2-(5,6,7,8-tetrahydronaphthalen-2-ylmethyl)propyl]-5,6,7,8-tetrahydronaphthalene-1-carboxylic acid 6-[3-hydroxy-3-oxo-2-(tetralin-6-ylmethyl)propyl]tetralin-5-carboxylic acid 2-[2-carboxy-3-(5,6,7,8-tetrahydronaphthalen-2-yl)propyl]-5,6,7,8-tetrahydronaphthalene-1-carboxylic acid
Wiley ID 1366004