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4,exo-7,syn-8-tribrombicyclo[4.1.1]oct-4-en-endo-3-yl-nitrat
SpectraBase Compound ID GdQyyttnjHY
InChI InChI=1S/C8H8Br3NO3/c9-5-1-3-7(10)4(8(3)11)2-6(5)15-12(13)14/h1,3-4,6-8H,2H2/t3-,4+,6?,7?,8?
InChIKey MDDUAUMPTTYHGD-VPKOVEDFSA-N
Mol Weight 405.87 g/mol
Molecular Formula C8H8Br3NO3
Exact Mass 402.805432 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 24HUwYMu6QK
Name 4,exo-7,syn-8-tribrombicyclo[4.1.1]oct-4-en-endo-3-yl-nitrat
Alternate Name(s) 4,7,8-tribromobicyclo[4.1.1]oct-4-en-3-yl nitrate
CAS Registry Number 103148-61-4
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H8Br3NO3
InChI InChI=1S/C8H8Br3NO3/c9-5-1-3-7(10)4(8(3)11)2-6(5)15-12(13)14/h1,3-4,6-8H,2H2/t3-,4+,6?,7?,8?
InChIKey MDDUAUMPTTYHGD-VPKOVEDFSA-N
Molecular Weight 405.868 g/mol
SMILES [C@]12(C=C(C(ON(=O)=O)C[C@](C2Br)(C1Br)[H])Br)[H]
SPLASH splash10-0006-9000000000-bc4cea58cc2679fb25ea
Source of Spectrum K-119-3054-13
Wiley ID 1370759