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2(3H)-Benzoxazolone, 3-(2,4-dinitrophenyl)-
SpectraBase Compound ID 7q62JAmvFuq
InChI InChI=1S/C13H7N3O6/c17-13-14(10-3-1-2-4-12(10)22-13)9-6-5-8(15(18)19)7-11(9)16(20)21/h1-7H
InChIKey JWSBFYHORZZCOX-UHFFFAOYSA-N
Mol Weight 301.21 g/mol
Molecular Formula C13H7N3O6
Exact Mass 301.033485 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lef3gcp2lpx
Name 2(3H)-Benzoxazolone, 3-(2,4-dinitrophenyl)-
Alternate Name(s) 3-(2,4-dinitrophenyl)-1,3-benzoxazol-2-one
CAS Registry Number 105999-11-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H7N3O6
InChI InChI=1S/C13H7N3O6/c17-13-14(10-3-1-2-4-12(10)22-13)9-6-5-8(15(18)19)7-11(9)16(20)21/h1-7H
InChIKey JWSBFYHORZZCOX-UHFFFAOYSA-N
Molecular Weight 301.214 g/mol
SMILES C1(N(c2c(O1)cccc2)c1c(N(=O)=O)cc(N(=O)=O)cc1)=O
SPLASH splash10-0udi-1109000000-7a5a8577e4fbc16cd558
Source of Spectrum Y-22-1578-3
Wiley ID 1303620