| SpectraBase Spectrum ID |
4v2kVbtas3x |
| Name |
3-[(4-Nitrobenzoyl)oxy]propyl 4-nitrobenzoate |
| CAS Registry Number |
57609-63-9 |
| Comments |
Note: The molecular formula of the structure shown is C17H14N2O8 - which differs from the formula reported for the mass spectrum (C17H12D2N2O8) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H12D2N2O8 |
| InChI |
InChI=1S/C17H14N2O8/c20-16(12-2-6-14(7-3-12)18(22)23)26-10-1-11-27-17(21)13-4-8-15(9-5-13)19(24)25/h2-9H,1,10-11H2 |
| InChIKey |
DGEHMXCYTLBOBT-UHFFFAOYSA-N |
| Molecular Weight |
374.305 g/mol |
| SMILES |
c1(N(=O)=O)ccc(cc1)C(=O)OCCCOC(=O)c1ccc(cc1)N(=O)=O |
| SPLASH |
splash10-0udi-4910000000-f5d3f94479f26c3c4c5f |
| Synonyms |
1,3-Propanediol, bis(4-nitrobenzoate)
3-(4-nitrobenzoyl)oxypropyl 4-nitrobenzoate
3-(4-nitrophenyl)carbonyloxypropyl 4-nitrobenzoate
4-Nitrobenzoic acid 3-(4-nitrobenzoyl)oxypropyl ester
4-Nitrobenzoic acid 3-[(4-nitrophenyl)-oxomethoxy]propyl ester |
| Wiley ID |
1478731 |
![3-[(4-Nitrobenzoyl)oxy]propyl 4-nitrobenzoate](/api/spectrum/4v2kVbtas3x/structure.png?h=300&w=458 "3-[(4-Nitrobenzoyl)oxy]propyl 4-nitrobenzoate")
