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5,8-Epoxynaphtho[2,3-d]-1,3-dioxole-6-carboxylic acid, 5-cyano-5,6,7,8-tetrahydro-, methyl ester
SpectraBase Compound ID p9xQH8WBfI
InChI InChI=1S/C14H11NO5/c1-17-13(16)9-4-10-7-2-11-12(19-6-18-11)3-8(7)14(9,5-15)20-10/h2-3,9-10H,4,6H2,1H3
InChIKey KRCLRVQSJJVRSM-UHFFFAOYSA-N
Mol Weight 273.24 g/mol
Molecular Formula C14H11NO5
Exact Mass 273.063722 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EAwIwexD7u1
Name 5,8-Epoxynaphtho[2,3-d]-1,3-dioxole-6-carboxylic acid, 5-cyano-5,6,7,8-tetrahydro-, methyl ester
Alternate Name(s) Methyl 11-cyano-5,7,14-trioxatetracyclo[9.2.1.0(2,10).0(4,8)]tetradeca-2(10),3,8-triene-12-carboxylate 1-cyano-2-methoxycarbonyl-1,4-epoxy-6,7-methylendioxy-1,2,3,4-tetrahydronaphtalene
CAS Registry Number 104172-51-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H11NO5
InChI InChI=1S/C14H11NO5/c1-17-13(16)9-4-10-7-2-11-12(19-6-18-11)3-8(7)14(9,5-15)20-10/h2-3,9-10H,4,6H2,1H3
InChIKey KRCLRVQSJJVRSM-UHFFFAOYSA-N
Molecular Weight 273.244 g/mol
SMILES C12(C(CC(O2)c2c1cc1c(OCO1)c2)C(=O)OC)C#N
SPLASH splash10-000i-0900000000-090421078027a0139829
Source of Spectrum J-51-3977-20
Wiley ID 1277136