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7,8,9-trinitro-2,3,4,5-tetrahydro-1,6-benzodioxocin
SpectraBase Compound ID 26mabHQmpMO
InChI InChI=1S/C10H9N3O8/c14-11(15)6-5-7-10(21-4-2-1-3-20-7)9(13(18)19)8(6)12(16)17/h5H,1-4H2
InChIKey ZHVBDEVMAZGSMD-UHFFFAOYSA-N
Mol Weight 299.2 g/mol
Molecular Formula C10H9N3O8
Exact Mass 299.038964 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GuKGTztNQ7L
Name 7,8,9-trinitro-2,3,4,5-tetrahydro-1,6-benzodioxocin
CAS Registry Number 127704-72-7
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H9N3O8
InChI InChI=1S/C10H9N3O8/c14-11(15)6-5-7-10(21-4-2-1-3-20-7)9(13(18)19)8(6)12(16)17/h5H,1-4H2
InChIKey ZHVBDEVMAZGSMD-UHFFFAOYSA-N
Molecular Weight 299.195 g/mol
SMILES c1(c(N(=O)=O)c2OCCCCOc2cc1N(=O)=O)N(=O)=O
SPLASH splash10-0a4i-9000000000-c0fdc7f4d128b5760d60
Source of Spectrum Y-27-179-8
Synonyms 7,8,9-trinitro-2,3,4,5-tetrahydro-1,6-benzodioxocine
Wiley ID 1301708