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2-(.alpha-Hydroxy-4-nitrobenzyl)-4-isopropyltropone
SpectraBase Compound ID BI3Pr4RUo0m
InChI InChI=1S/C17H17NO4/c1-11(2)13-4-3-5-16(19)15(10-13)17(20)12-6-8-14(9-7-12)18(21)22/h3-11,17,20H,1-2H3
InChIKey USVTUSKCRIKDGK-UHFFFAOYSA-N
Mol Weight 299.33 g/mol
Molecular Formula C17H17NO4
Exact Mass 299.115758 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4n7uzGEA55H
Name 2-(.alpha-Hydroxy-4-nitrobenzyl)-4-isopropyltropone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H17NO4
InChI InChI=1S/C17H17NO4/c1-11(2)13-4-3-5-16(19)15(10-13)17(20)12-6-8-14(9-7-12)18(21)22/h3-11,17,20H,1-2H3
InChIKey USVTUSKCRIKDGK-UHFFFAOYSA-N
Molecular Weight 299.326 g/mol
SMILES OC(C1=CC(=CC=CC1=O)C(C)C)c1ccc(N(=O)=O)cc1
SPLASH splash10-0002-0191000000-bee4b3d54b0ecba2ae12
Source of Spectrum AJ-64-3312-32
Synonyms 2-(..alpha.-hydroxy-4-nitrobenzyl)-4-isopropyltropone 2-[hydroxy(4-nitrophenyl)methyl]-4-isopropyl-2,4,6-cycloheptatrien-1-one
Wiley ID 1302045