2-Cyclopenten-1-one, 4-methoxy-5-[(3,5-dinitrobenzoyl)oxy]-, trans-(.+-.)-

SpectraBase Compound ID	CDzBMZ0aDKu
InChI	InChI=1S/C13H10N2O8/c1-22-11-3-2-10(16)12(11)23-13(17)7-4-8(14(18)19)6-9(5-7)15(20)21/h2-6,11-12H,1H3/t11-,12-/m0/s1
InChIKey	XZJLKZOTTZLCTA-RYUDHWBXSA-N Google Search
Mol Weight	322.23 g/mol
Molecular Formula	C13H10N2O8
Exact Mass	322.043715 g/mol

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SpectraBase Spectrum ID	EA1FL46ToZZ
Name	2-Cyclopenten-1-one, 4-methoxy-5-[(3,5-dinitrobenzoyl)oxy]-, trans-(.+-.)-
Alternate Name(s)	(1R,2S)-2-methoxy-5-oxo-3-cyclopenten-1-yl 3,5-dinitrobenzoate (4S,5R)-5-(3,5-dinitrophenylcarbonyloxy)-4-methocy-2-cyclopentenone 3,5-Dinitrobenzoic acid[(1R,2S)-2-methoxy-5-oxo-1-cyclopent-3-enyl]ester 3,5-Dinitrobenzoic acid[(1R,5S)-2-keto-5-methoxy-cyclopent-3-en-1-yl]ester [(1R,2S)-2-methoxy-5-oxidanylidene-cyclopent-3-en-1-yl]3,5-dinitrobenzoate [(1R,2S)-2-methoxy-5-oxo-cyclopent-3-en-1-yl]3,5-dinitrobenzoate 3,5-Dinitrobenzoic acid [(1R,2S)-2-methoxy-5-oxo-1-cyclopent-3-enyl] ester [(1R,2S)-2-methoxy-5-oxocyclopent-3-en-1-yl] 3,5-dinitrobenzoate [(1R,2S)-2-methoxy-5-oxo-cyclopent-3-en-1-yl] 3,5-dinitrobenzoate [(1R,2S)-2-methoxy-5-oxidanylidene-cyclopent-3-en-1-yl] 3,5-dinitrobenzoate
CAS Registry Number	129076-59-1
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C13H10N2O8
InChI	InChI=1S/C13H10N2O8/c1-22-11-3-2-10(16)12(11)23-13(17)7-4-8(14(18)19)6-9(5-7)15(20)21/h2-6,11-12H,1H3/t11-,12-/m0/s1
InChIKey	XZJLKZOTTZLCTA-RYUDHWBXSA-N
Molecular Weight	322.229 g/mol
SMILES	c1(N(=O)=O)cc(N(=O)=O)cc(C(O[C@]2(C(C=C[C@@]2(OC)[H])=O)[H])=O)c1
SPLASH	splash10-0002-9601000000-93451c945ea79cd99cdb
Source of Spectrum	F-46-2605-25
Wiley ID	1321305