| SpectraBase Spectrum ID |
5YHaa7JLbwb |
| Name |
anti,syn-4,6-Dimethyl-2-(3???,5???-dinitrobenzoyloxy)-7-(triphenylmethyloxy)heptane |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C35H36N2O7 |
| InChI |
InChI=1S/C35H36N2O7/c1-25(20-27(3)44-34(38)28-21-32(36(39)40)23-33(22-28)37(41)42)19-26(2)24-43-35(29-13-7-4-8-14-29,30-15-9-5-10-16-30)31-17-11-6-12-18-31/h4-18,21-23,25-27H,19-20,24H2,1-3H3/t25-,26+,27+/m1/s1 |
| InChIKey |
CTLTVCONMXSGPD-PVHODMMVSA-N |
| Instrument Name |
Fisons NV GC 8060 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3762/bjoc.10.72 |
| Molecular Weight |
596.680 g/mol |
| SMILES |
C([C@](C[C@](C[C@@](OC(c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-])=O)(C)[H])(C)[H])(C)[H])OC(c1ccccc1)(c1ccccc1)c1ccccc1 |
| SPLASH |
splash10-0006-4490000000-9fc016c5e23aa13a6fe4 |
| Source of Spectrum |
BJO-10-SM16-15-1 |
| Wiley ID |
1854160 |
