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7-Octene-2,4-diol, bis(4-nitrobenzoate)
SpectraBase Compound ID EyJTS8cN7Pm
InChI InChI=1S/C22H22N2O8/c1-3-4-5-20(32-22(26)17-8-12-19(13-9-17)24(29)30)14-15(2)31-21(25)16-6-10-18(11-7-16)23(27)28/h3,6-13,15,20H,1,4-5,14H2,2H3
InChIKey VIWCMELDGAGGAM-UHFFFAOYSA-N
Mol Weight 442.42 g/mol
Molecular Formula C22H22N2O8
Exact Mass 442.137616 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BDy3gOkgGPA
Name 7-Octene-2,4-diol, bis(4-nitrobenzoate)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H22N2O8
InChI InChI=1S/C22H22N2O8/c1-3-4-5-20(32-22(26)17-8-12-19(13-9-17)24(29)30)14-15(2)31-21(25)16-6-10-18(11-7-16)23(27)28/h3,6-13,15,20H,1,4-5,14H2,2H3
InChIKey VIWCMELDGAGGAM-UHFFFAOYSA-N
Molecular Weight 442.424 g/mol
SMILES c1cc(ccc1N(=O)=O)C(=O)OC(CCC=C)CC(C)OC(=O)c1ccc(cc1)N(=O)=O
SPLASH splash10-0udi-5920000000-21abe0fd5d6d79dd619d
Synonyms 1-(2-[(4-Nitrobenzoyl)oxy]propyl)-4-pentenyl 4-nitrobenzoate 4-(4-nitrobenzoyl)oxyoct-7-en-2-yl 4-nitrobenzoate 4-(4-nitrophenyl)carbonyloxyoct-7-en-2-yl 4-nitrobenzoate 4-Nitrobenzoic acid 4-[(4-nitrophenyl)-oxomethoxy]oct-7-en-2-yl ester [1-methyl-3-(4-nitrobenzoyl)oxy-hept-6-enyl] 4-nitrobenzoate
Wiley ID 1480129