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3,5-Dinitrobenzoic acid, 2-(4-methylcyclohex-3-enyl)propyl ester
SpectraBase Compound ID BeN0t6Qn4gR
InChI InChI=1S/C17H20N2O6/c1-11-3-5-13(6-4-11)12(2)10-25-17(20)14-7-15(18(21)22)9-16(8-14)19(23)24/h3,7-9,12-13H,4-6,10H2,1-2H3
InChIKey TZKSWOPKNUMVAR-UHFFFAOYSA-N
Mol Weight 348.36 g/mol
Molecular Formula C17H20N2O6
Exact Mass 348.132136 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DEoqdFvU7mI
Name 3,5-DINITROBENZOIC ACID, 2-(4-METHYLCYCLOHEX-3-ENYL)PROPYL ESTER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C17H20N2O6
InChI InChI=1S/C17H20N2O6/c1-11-3-5-13(6-4-11)12(2)10-25-17(20)14-7-15(18(21)22)9-16(8-14)19(23)24/h3,7-9,12-13H,4-6,10H2,1-2H3
InChIKey TZKSWOPKNUMVAR-UHFFFAOYSA-N
Molecular Weight 348.1316
SMILES CC=1CCC(C(COC(c2cc(N(=O)=O)cc(N(=O)=O)c2)=O)C)CC1
SPLASH splash10-0006-9300000000-8b7b365f7286be8f8ed9
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany