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Acetic acid 3-(4-chloro-phenyl)-2-hydroxymethyl-2-nitro-propyl ester
SpectraBase Compound ID HxIKvSDdKJr
InChI InChI=1S/C12H14ClNO5/c1-9(16)19-8-12(7-15,14(17)18)6-10-2-4-11(13)5-3-10/h2-5,15H,6-8H2,1H3
InChIKey UCZLFYHSZUUIIA-UHFFFAOYSA-N
Mol Weight 287.7 g/mol
Molecular Formula C12H14ClNO5
Exact Mass 287.05605 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IdIp4egrcVW
Name Acetic acid 3-(4-chloro-phenyl)-2-hydroxymethyl-2-nitro-propyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14ClNO5
InChI InChI=1S/C12H14ClNO5/c1-9(16)19-8-12(7-15,14(17)18)6-10-2-4-11(13)5-3-10/h2-5,15H,6-8H2,1H3
InChIKey UCZLFYHSZUUIIA-UHFFFAOYSA-N
Molecular Weight 287.699 g/mol
SMILES OCC(N(=O)=O)(Cc1ccc(cc1)Cl)COC(=O)C
SPLASH splash10-0fvm-2900000000-3eddc7774e5b64a48273
Source of Spectrum D1-2006-1204-2
Synonyms 2-(4-Chlorobenzyl)-3-hydroxy-2-nitropropyl acetate 2-Nitro-2-[(p-chlorophenyl)methyl]-3-(acetoxymethyl)-propan-1-ol
Wiley ID 1614059