SpectraBase Compound ID | 25CAzFmAMJx |
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InChI | InChI=1S/C12H13N5O10/c18-8(19)1-3-13-10-6(15(22)23)5-7(16(24)25)11(12(10)17(26)27)14-4-2-9(20)21/h5,13-14H,1-4H2,(H,18,19)(H,20,21) |
InChIKey | CGCAQNMNWNMVMD-UHFFFAOYSA-N |
Mol Weight | 387.26 g/mol |
Molecular Formula | C12H13N5O10 |
Exact Mass | 387.066242 g/mol |
SpectraBase Spectrum ID | 5YN44p39paU |
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Name | N,N'-(2,4,6-trinitro-m-phenylene)di-beta-alanine |
Conditions | Neutral |
Copyright | Copyright © 2008-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C12H13N5O10 |
InChI | InChI=1S/C12H13N5O10/c18-8(19)1-3-13-10-6(15(22)23)5-7(16(24)25)11(12(10)17(26)27)14-4-2-9(20)21/h5,13-14H,1-4H2,(H,18,19)(H,20,21) |
InChIKey | CGCAQNMNWNMVMD-UHFFFAOYSA-N |
Sadtler IR Number | 2429 |
Sadtler UV Number | 628N |
Solvent | Methanol |