SpectraBase Spectrum ID |
Fs14z1i2s43 |
Name |
Ethanone, 2-[1-[[6,10-dimethyl-2-[(phenylthio)methyl]undecyl]oxy]-5-methyl-2-(1-methylethyl)cyclohexyl]-1-phenyl-, [1S-[1.alpha.(2S*,6S*),2.alpha.,5.beta.]]- |
CAS Registry Number |
105857-75-8 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C38H58O2S |
InChI |
InChI=1S/C38H58O2S/c1-29(2)15-13-16-31(5)17-14-18-33(28-41-35-21-11-8-12-22-35)27-40-38(25-32(6)23-24-36(38)30(3)4)26-37(39)34-19-9-7-10-20-34/h7-12,19-22,29-33,36H,13-18,23-28H2,1-6H3/t31-,32-,33?,36+,38+/m1/s1 |
InChIKey |
OHDJRLQGTMKHDH-AXXSAYNFSA-N |
Molecular Weight |
578.940 g/mol |
SMILES |
[C@]1(CC(=O)c2ccccc2)([C@@](CC[C@](C1)(C)[H])(C(C)C)[H])OCC(CSc1ccccc1)CCC[C@@](CCCC(C)C)(C)[H] |
SPLASH |
splash10-0a4i-0904000000-d22c55113c0228619f29 |
Source of Spectrum |
C-109-531-10 |
Synonyms |
2-[(1S,2S,5R)-1-({(6R)-6,10-dimethyl-2-[(phenylsulfanyl)methyl]undecyl}oxy)-2-isopropyl-5-methylcyclohexyl]-1-phenylethanone
6,10-Dimethyl-2-hydroxymethyl-undecanol |
Wiley ID |
1408396 |