SpectraBase Spectrum ID |
5Pk3vBg52k2 |
Name |
syn,anti-2-(.alpha.-Dimethylamino-2-chlorobenzyl)-1-mesityloxycyclohexane |
Comments |
Note: The molecular formula of the structure shown is C24H32ClNO - which differs from the formula reported for the mass spectrum (C18H28ClNO3S) |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C18H28ClNO3S |
InChI |
InChI=1S/C24H32ClNO/c1-16-14-17(2)24(18(3)15-16)27-22-13-9-7-11-20(22)23(26(4)5)19-10-6-8-12-21(19)25/h6,8,10,12,14-15,20,22-23H,7,9,11,13H2,1-5H3 |
InChIKey |
BINKYGPUMIMSTL-UHFFFAOYSA-N |
Molecular Weight |
385.979 g/mol |
SMILES |
C1(C(CCCC1)C(c1c(cccc1)Cl)N(C)C)Oc1c(C)cc(C)cc1C |
SPLASH |
splash10-0002-0490000000-01b3377cd8709be95662 |
Source of Spectrum |
SO-0-1370-8 |
Synonyms |
anti,anti-2-(.alpha.-Dimethylamino-2-chlorobenzyl)-1-mesityloxycyclohexane |
Wiley ID |
865012 |