| SpectraBase Spectrum ID |
K6Om6DeNEYa |
| Name |
4-Hexen-2-ol, 3-(diphenylphosphinyl)-3,4-dimethyl-, 3,5-dinitrobenzoate, [R*,S*-(E)]-(.+-.)- |
| Alternate Name(s) |
(1S,2R,3E)-2-(diphenylphosphoryl)-1,2,3-trimethyl-3-pentenyl 3,5-dinitrobenzoate
3,5-Dinitrobenzoic acid, (2RS,3SR)-3-diphenylphosphinoyl-3,4-dimethylhex-4-en-2-yl ester |
| CAS Registry Number |
63103-42-4 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H27N2O7P |
| InChI |
InChI=1S/C27H27N2O7P/c1-5-19(2)27(4,37(35,24-12-8-6-9-13-24)25-14-10-7-11-15-25)20(3)36-26(30)21-16-22(28(31)32)18-23(17-21)29(33)34/h5-18,20H,1-4H3/b19-5+/t20-,27+/m0/s1 |
| InChIKey |
WRRSGQZEGGTOAX-GHDAVZKASA-N |
| Molecular Weight |
522.494 g/mol |
| SMILES |
[C@@](P(=O)(c1ccccc1)c1ccccc1)([C@@](OC(c1cc(N(=O)=O)cc(N(=O)=O)c1)=O)(C)[H])(\C(=C\C)C)C |
| SPLASH |
splash10-0w30-0093000000-8fe715af632439c1234b |
| Source of Spectrum |
KC-1977-5-560 |
| Wiley ID |
1402232 |
![4-Hexen-2-ol, 3-(diphenylphosphinyl)-3,4-dimethyl-, 3,5-dinitrobenzoate, [R*,S*-(E)]-(.+-.)-](/api/spectrum/K6Om6DeNEYa/structure.png?h=300&w=458 "4-Hexen-2-ol, 3-(diphenylphosphinyl)-3,4-dimethyl-, 3,5-dinitrobenzoate, [R*,S*-(E)]-(.+-.)-")
