| SpectraBase Spectrum ID |
FXA3MQDAJGG |
| Name |
6,7,9-trichlorononacyclo[12.8.1.1(4,11).1(17,20).0(2,13).0(3,12).0(5,10).0(15,22).0(16,21)]pentacosan-5,7,9,18-tetraene |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H23Cl3 |
| InChI |
InChI=1S/C25H23Cl3/c26-13-6-14(27)25(28)24-12-4-9(17(13)24)20-21-10-5-11(22(21)23(12)20)19-16-8-2-1-7(3-8)15(16)18(10)19/h1-2,6-12,15-16,18-23H,3-5H2/t7-,8+,9-,10-,11+,12-,15-,16-,18-,19+,20+,21?,22?,23-/m1/s1 |
| InChIKey |
ZVHUFUGOIDJEIF-ZCGUHUTMSA-N |
| Instrument Name |
VG70-250S |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/jccs.202100205 |
| Molecular Weight |
429.818 g/mol |
| SMILES |
C=1[C@]2(C[C@@](C1)([C@]1([C@@]3([C@@]([C@]4(C5[C@@]6([C@]7(C[C@](c8c7c(c(cc8Cl)Cl)Cl)([C@]6(C5[C@@]3(C4)[H])[H])[H])[H])[H])[H])([C@]21[H])[H])[H])[H])[H])[H] |
| SPLASH |
splash10-014i-0931100000-a3bd3471fa9626cf23ca |
| Source of Spectrum |
QA-68-2219-NB10 |
| Wiley ID |
1871877 |
![6,7,9-trichlorononacyclo[12.8.1.1(4,11).1(17,20).0(2,13).0(3,12).0(5,10).0(15,22).0(16,21)]pentacosan-5,7,9,18-tetraene](/api/spectrum/FXA3MQDAJGG/structure.png?h=300&w=458 "6,7,9-trichlorononacyclo[12.8.1.1(4,11).1(17,20).0(2,13).0(3,12).0(5,10).0(15,22).0(16,21)]pentacosan-5,7,9,18-tetraene")
