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[(1R,2S)-2-(5-methyl-2,4-dioxo-pyrimidin-1-yl)cyclopentyl]methyl benzoate
SpectraBase Compound ID 27fO1rV1O9e
InChI InChI=1S/C18H20N2O4/c1-12-10-20(18(23)19-16(12)21)15-9-5-8-14(15)11-24-17(22)13-6-3-2-4-7-13/h2-4,6-7,10,14-15H,5,8-9,11H2,1H3,(H,19,21,23)/t14-,15-/m0/s1
InChIKey QOMCCCDZVFQRQV-GJZGRUSLSA-N
Mol Weight 328.37 g/mol
Molecular Formula C18H20N2O4
Exact Mass 328.142307 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6bq1epF5DoO
Name [(1R,2S)-2-(5-methyl-2,4-dioxo-pyrimidin-1-yl)cyclopentyl]methyl benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20N2O4
InChI InChI=1S/C18H20N2O4/c1-12-10-20(18(23)19-16(12)21)15-9-5-8-14(15)11-24-17(22)13-6-3-2-4-7-13/h2-4,6-7,10,14-15H,5,8-9,11H2,1H3,(H,19,21,23)/t14-,15-/m0/s1
InChIKey QOMCCCDZVFQRQV-GJZGRUSLSA-N
Molecular Weight 328.368 g/mol
SMILES N1C(C(=CN(C1=O)[C@@]1([C@](COC(=O)c2ccccc2)(CCC1)[H])[H])C)=O
SPLASH splash10-056r-9810000000-1edfac42d8f4a6b9a429
Source of Spectrum SO-0-1534-6
Synonyms [(1R,2S)-2-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]cyclopentyl]methyl benzoate benzoic acid [(1R,2S)-2-(5-methyl-2,4-dioxo-1-pyrimidinyl)cyclopentyl]methyl ester [(1R,2S)-2-(5-methyl-2,4-dioxopyrimidin-1-yl)cyclopentyl]methyl benzoate
Wiley ID 878662