SpectraBase Spectrum ID |
1LIYgmm7670 |
Name |
Spiro[4.5]decan-7-one, 1-methyl-4-(1-methylethyl)-8-(phenylthio)-, (1.alpha.,4.alpha.,5.alpha.)-(.+-.)- |
CAS Registry Number |
65408-95-9 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C20H28OS |
InChI |
InChI=1S/C20H28OS/c1-14(2)17-10-9-15(3)20(17)12-11-19(18(21)13-20)22-16-7-5-4-6-8-16/h4-8,14-15,17,19H,9-13H2,1-3H3/t15-,17-,19?,20+/m1/s1 |
InChIKey |
AQXCCEJXBUSBPN-UFOQZSBZSA-N |
Molecular Weight |
316.503 g/mol |
SMILES |
[C@]12(CC(=O)C(CC2)Sc2ccccc2)[C@](CC[C@]1(C)[H])(C(C)C)[H] |
SPLASH |
splash10-0a4j-7790000000-de25c5360774715992f8 |
Source of Spectrum |
H-60-2400-0 |
Synonyms |
(1R*,4S*,5R*)-7-Isopropyl-4-methyl-8-phenylthio-spiro(4.5)decan-7-one
(1R,4R,5S)-1-isopropyl-4-methyl-8-(phenylsulfanyl)spiro[4.5]decan-7-one |
Wiley ID |
1317021 |