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6-cyclopropanecarbonyl-7-nitro-2,3-dihydro-1,4-benzodioxine
SpectraBase Compound ID B9FWIvOl4SO
InChI InChI=1S/C12H11NO5/c14-12(7-1-2-7)8-5-10-11(18-4-3-17-10)6-9(8)13(15)16/h5-7H,1-4H2
InChIKey IGRBJPKAWMALAS-UHFFFAOYSA-N
Mol Weight 249.22 g/mol
Molecular Formula C12H11NO5
Exact Mass 249.063722 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 23H9X3KIMq
Name 6-cyclopropanecarbonyl-7-nitro-2,3-dihydro-1,4-benzodioxine
Alternate Name(s) Methanone, cyclopropyl(2,3-dihydro-7-nitro-1,4-benzodioxin-6-yl)-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11NO5
InChI InChI=1S/C12H11NO5/c14-12(7-1-2-7)8-5-10-11(18-4-3-17-10)6-9(8)13(15)16/h5-7H,1-4H2
InChIKey IGRBJPKAWMALAS-UHFFFAOYSA-N
Molecular Weight 249.222 g/mol
SMILES c1(c(N(=O)=O)cc2c(c1)OCCO2)C(C1CC1)=O
SPLASH splash10-0uy3-9200000000-2784aa9251d891c52f37
Source of Spectrum IY-2-5092-2
Wiley ID 1658905