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(anti/syn)-1-Nitro-1-phenylpropan-2-yl nitrate
SpectraBase Compound ID JVHuGWms7H6
InChI InChI=1S/C9H10N2O5/c1-7(16-11(14)15)9(10(12)13)8-5-3-2-4-6-8/h2-7,9H,1H3
InChIKey LPFDRKBCDYIGLI-UHFFFAOYSA-N
Mol Weight 226.19 g/mol
Molecular Formula C9H10N2O5
Exact Mass 226.058971 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9g7asTCtpwz
Name (anti/syn)-1-Nitro-1-phenylpropan-2-yl nitrate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H10N2O5
InChI InChI=1S/C9H10N2O5/c1-7(16-11(14)15)9(10(12)13)8-5-3-2-4-6-8/h2-7,9H,1H3
InChIKey LPFDRKBCDYIGLI-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cssc.201500188
Molecular Weight 226.188 g/mol
SMILES C(O[N+](=O)[O-])(C(c1ccccc1)[N+](=O)[O-])C
SPLASH splash10-014i-1900000000-a3901aecdab31ea5cd85
Source of Spectrum CSC-8-3173-5c
Synonyms 1-Nitro-1-phenylpropan-2-yl nitrate
Wiley ID 1799326