SpectraBase Spectrum ID |
4Gi0oltIfrR |
Name |
4-Nitrobenzoic acid (2S*,3S*)-4-methylene-5-oxo-2-pentyltetrahydrofuran-3-yl methyl ester |
Alternate Name(s) |
[(2S,3S)-4-methylene-5-oxo-2-pentyltetrahydro-3-furanyl]methyl 4-nitrobenzoate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C18H21NO6 |
InChI |
InChI=1S/C18H21NO6/c1-3-4-5-6-16-15(12(2)17(20)25-16)11-24-18(21)13-7-9-14(10-8-13)19(22)23/h7-10,15-16H,2-6,11H2,1H3/t15-,16+/m1/s1 |
InChIKey |
PNFIWWFYDTXGDU-CVEARBPZSA-N |
Molecular Weight |
347.367 g/mol |
SMILES |
C1(C([C@@](COC(c2ccc(N(=O)=O)cc2)=O)([C@@](O1)(CCCCC)[H])[H])=C)=O |
SPLASH |
splash10-0udi-0900000000-54bf2921adf96ccdf76e |
Source of Spectrum |
KC-61-2719-25 |
Wiley ID |
1628196 |