| SpectraBase Spectrum ID |
DxorH2wydwn |
| Name |
3-chlor-endo-6,syn-7-diiodbicyclo[3.1.1]hept-3-en-2-yl-4-nitrobenzoat |
| Alternate Name(s) |
3-chloro-6,7-diiodobicyclo[3.1.1]hept-3-en-2-yl 4-nitrobenzoate |
| CAS Registry Number |
102870-44-0 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H10ClI2NO4 |
| InChI |
InChI=1S/C14H10ClI2NO4/c15-9-5-8-11(16)10(12(8)17)13(9)22-14(19)6-1-3-7(4-2-6)18(20)21/h1-5,8,10-13H/t8-,10+,11?,12?,13? |
| InChIKey |
ABEKHNVJEOMIJF-ZSMWZICSSA-N |
| Molecular Weight |
545.499 g/mol |
| SMILES |
[C@]12(C(C(Cl)=C[C@](C2I)(C1I)[H])OC(c1ccc(N(=O)=O)cc1)=O)[H] |
| SPLASH |
splash10-0udi-0900000000-e84dc18a6cdb2ed979b6 |
| Source of Spectrum |
K-119-3039-3 |
| Wiley ID |
1405138 |
![3-chlor-endo-6,syn-7-diiodbicyclo[3.1.1]hept-3-en-2-yl-4-nitrobenzoat](/api/spectrum/DxorH2wydwn/structure.png?h=300&w=458 "3-chlor-endo-6,syn-7-diiodbicyclo[3.1.1]hept-3-en-2-yl-4-nitrobenzoat")
