SpectraBase Spectrum ID |
644GkisMscr |
Name |
2.beta.-Carbomethoxy-3.beta.-(4-chlorophenyl)-8-[(E)-3-(tributylstannyl)propen-1-yl]bortropane |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C30H48ClNO2Sn |
InChI |
InChI=1S/C18H21ClNO2.3C4H9.Sn/c1-3-10-20-14-8-9-16(20)17(18(21)22-2)15(11-14)12-4-6-13(19)7-5-12;3*1-3-4-2;/h1,3-7,14-17H,8-11H2,2H3;3*1,3-4H2,2H3;/t14-,15+,16+,17-;;;;/m0..../s1 |
InChIKey |
ZCFUSBZWBZNGBD-NPMYLGTKSA-N |
Molecular Weight |
608.883 g/mol |
SMILES |
[C@@]1([C@@]2(N(C\C=C\[Sn](CCCC)(CCCC)CCCC)[C@](C[C@@]1(c1ccc(cc1)Cl)[H])(CC2)[H])[H])(C(=O)OC)[H] |
SPLASH |
splash10-0udi-0000090000-27b5b85ca7a862a32ebc |
Source of Spectrum |
E1-37-1540-7 |
Synonyms |
2.beta.-Carbomethoxy-3.beta.-(4-chlorophenyl)-8-[(Z)-3-(tributylstannyl)propen-1-yl]bortropane |
Wiley ID |
1575072 |