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Tricyclo[9.3.1.1(4,8)]hexadeca-1(15),4,6,8(16),11,13-hexaene-5-carboxylic acid, 12-(hydroxymethyl)-, methyl ester
SpectraBase Compound ID GqZfY79VZV
InChI InChI=1S/C19H20O3/c1-22-19(21)18-9-5-14-2-6-15-10-13(3-7-16(18)11-14)4-8-17(15)12-20/h4-5,8-11,20H,2-3,6-7,12H2,1H3
InChIKey MFJVMQGAKYLNJS-UHFFFAOYSA-N
Mol Weight 296.37 g/mol
Molecular Formula C19H20O3
Exact Mass 296.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4vjl06aQIt2
Name Tricyclo[9.3.1.1(4,8)]hexadeca-1(15),4,6,8(16),11,13-hexaene-5-carboxylic acid, 12-(hydroxymethyl)-, methyl ester
Alternate Name(s) Methyl 12-(hydroxymethyl)tricyclo[9.3.1.1(4,8)]hexadeca-1(15),4(16),5,7,11,13-hexaene-5-carboxylate Methyl ester of 12-hydroxymethyl-[2.2]metacyclophane-4-carboxylic acid
CAS Registry Number 56752-70-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H20O3
InChI InChI=1S/C19H20O3/c1-22-19(21)18-9-5-14-2-6-15-10-13(3-7-16(18)11-14)4-8-17(15)12-20/h4-5,8-11,20H,2-3,6-7,12H2,1H3
InChIKey MFJVMQGAKYLNJS-UHFFFAOYSA-N
Molecular Weight 296.366 g/mol
SMILES OCc1c2CCc3ccc(c(c3)CCc(c2)cc1)C(=O)OC
SPLASH splash10-0aor-0190000000-ea3ece7d27e4126715c8
Source of Spectrum AH-106-774-16
Wiley ID 1299446