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Picrate of trans-1-Bromopyrrolizidine
SpectraBase Compound ID L2IuNZQpSTy
InChI InChI=1S/C7H12BrN.C6H3N3O7/c8-6-3-5-9-4-1-2-7(6)9;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h6-7H,1-5H2;1-2,10H
InChIKey BBOVBXQTIUHGBT-UHFFFAOYSA-N
Mol Weight 419.19 g/mol
Molecular Formula C13H15BrN4O7
Exact Mass 418.012412 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3YBa6eD6nmq
Name Picrate of trans-1-Bromopyrrolizidine
Alternate Name(s) 2,4,6-trinitrophenol compound with 1-bromohexahydro-1H-pyrrolo[1,2-a]pyrrole (1:1)
CAS Registry Number 68225-94-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15BrN4O7
InChI InChI=1S/C7H12BrN.C6H3N3O7/c8-6-3-5-9-4-1-2-7(6)9;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h6-7H,1-5H2;1-2,10H
InChIKey BBOVBXQTIUHGBT-UHFFFAOYSA-N
Molecular Weight 419.188 g/mol
SMILES C12N(CCC2Br)CCC1.Oc1c(N(=O)=O)cc(N(=O)=O)cc1N(=O)=O
SPLASH splash10-001i-9200000000-804d0cd317e9fcd6bc63
Source of Spectrum J-44-290-0
Wiley ID 1376973