SpectraBase Spectrum ID |
5cd28yHgyEA |
Name |
(1S,2S,6S)-6-chloranyl-1,3,3-trimethyl-2-[(E,3R)-3-oxidanylbut-1-enyl]cyclohexan-1-ol |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C13H23ClO2 |
InChI |
InChI=1S/C13H23ClO2/c1-9(15)5-6-10-12(2,3)8-7-11(14)13(10,4)16/h5-6,9-11,15-16H,7-8H2,1-4H3/b6-5+/t9-,10+,11+,13+/m1/s1 |
InChIKey |
YYSBMMILZCGVNN-XRXKIVNCSA-N |
Molecular Weight |
246.778 g/mol |
SMILES |
O[C@@](\C=C\[C@@]1([C@@]([C@](CCC1(C)C)(Cl)[H])(O)C)[H])(C)[H] |
SPLASH |
splash10-00dj-0910000000-b0d4e1f1d052162af716 |
Source of Spectrum |
KC-0-277-7 |
Synonyms |
(1S,2S,6S)-6-chloro-2-[(E,3R)-3-hydroxybut-1-enyl]-1,3,3-trimethyl-1-cyclohexanol
(1S,2S,6S)-6-chloro-2-[(E,3R)-3-hydroxybut-1-enyl]-1,3,3-trimethyl-cyclohexanol
(1S,2S,6S)-6-chloro-2-[(E,3R)-3-hydroxybut-1-enyl]-1,3,3-trimethylcyclohexan-1-ol |
Wiley ID |
827372 |