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2-Naphthalenecarboxylic acid, 1,2,3,4-tetrahydro-8-methoxy-5-(3-oxobutyl)-, (.+-.)-
SpectraBase Compound ID H9rJCzyVaPj
InChI InChI=1S/C16H20O4/c1-10(17)3-4-11-6-8-15(20-2)14-9-12(16(18)19)5-7-13(11)14/h6,8,12H,3-5,7,9H2,1-2H3,(H,18,19)
InChIKey IGILBLZWGLQWKG-UHFFFAOYSA-N
Mol Weight 276.33 g/mol
Molecular Formula C16H20O4
Exact Mass 276.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3KnQj5rHRa1
Name 2-Naphthalenecarboxylic acid, 1,2,3,4-tetrahydro-8-methoxy-5-(3-oxobutyl)-, (.+-.)-
CAS Registry Number 80535-48-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20O4
InChI InChI=1S/C16H20O4/c1-10(17)3-4-11-6-8-15(20-2)14-9-12(16(18)19)5-7-13(11)14/h6,8,12H,3-5,7,9H2,1-2H3,(H,18,19)
InChIKey IGILBLZWGLQWKG-UHFFFAOYSA-N
Molecular Weight 276.332 g/mol
SMILES OC(C1Cc2c(CC1)c(CCC(=O)C)ccc2OC)=O
SPLASH splash10-014i-0090000000-f18c280bf7f48231667a
Source of Spectrum B-34-1895-0
Synonyms 8-Methoxy-5-(3'-oxobutyl)-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid 8-Methoxy-5-(3-oxobutyl)-1,2,3,4-tetrahydro-2-naphthalenecarboxylic acid
Wiley ID 1280137