| SpectraBase Spectrum ID |
my9pfa5b0j |
| Name |
2.beta.-Carbomethoxy-3.beta.-(4-chlorophenyl)-8-[(E)-3-iodopropen-1-yl]bortropane |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H21ClINO2 |
| InChI |
InChI=1S/C18H21ClINO2/c1-23-18(22)17-15(12-3-5-13(19)6-4-12)11-14-7-8-16(17)21(14)10-2-9-20/h2-6,10,14-17H,7-9,11H2,1H3/b10-2+/t14-,15+,16+,17-/m0/s1 |
| InChIKey |
MYKGOFWRSJZCQX-WTDSWWLTSA-N |
| Molecular Weight |
445.728 g/mol |
| SMILES |
[C@@]1([C@@]2(N(\C=C\CI)[C@](C[C@@]1(c1ccc(cc1)Cl)[H])(CC2)[H])[H])(C(=O)OC)[H] |
| SPLASH |
splash10-00kb-0007900000-c9560cf39e3dc049ee85 |
| Source of Spectrum |
E1-37-1541-13 |
| Wiley ID |
1575070 |
![2.beta.-Carbomethoxy-3.beta.-(4-chlorophenyl)-8-[(E)-3-iodopropen-1-yl]bortropane](/api/spectrum/my9pfa5b0j/structure.png?h=300&w=458 "2.beta.-Carbomethoxy-3.beta.-(4-chlorophenyl)-8-[(E)-3-iodopropen-1-yl]bortropane")
