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1-(4-Methoxyphenyl)-2-nitropropyl acetate
SpectraBase Compound ID ArPLPLv5CPg
InChI InChI=1S/C12H15NO5/c1-8(13(15)16)12(18-9(2)14)10-4-6-11(17-3)7-5-10/h4-8,12H,1-3H3
InChIKey SJXJORLORRKYRV-UHFFFAOYSA-N
Mol Weight 253.25 g/mol
Molecular Formula C12H15NO5
Exact Mass 253.095023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8sbLok9O8OU
Name 1-(4-Methoxyphenyl)-2-nitropropyl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H15NO5
InChI InChI=1S/C12H15NO5/c1-8(13(15)16)12(18-9(2)14)10-4-6-11(17-3)7-5-10/h4-8,12H,1-3H3
InChIKey SJXJORLORRKYRV-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.200700600
Molecular Weight 253.254 g/mol
SMILES c1cc(C(C([N+](=O)[O-])C)OC(C)=O)ccc1OC
SPLASH splash10-0007-1900000000-4cf3c0e5188dc95e4baf
Source of Spectrum ASC-350-1125/SM3-11
Synonyms Acetic acid [1-(4-methoxyphenyl)-2-nitropropyl] ester [1-(4-methoxyphenyl)-2-nitropropyl] acetate [1-(4-methoxyphenyl)-2-nitro-propyl] acetate [1-(4-methoxyphenyl)-2-nitro-propyl] ethanoate
Wiley ID 1766186