| SpectraBase Spectrum ID |
5QXXJBJXLH7 |
| Name |
de-ABC-cholestan-14-one ketal |
| Alternate Name(s) |
(6S,7R)-7-(1,5-dimethylhexyl)-6-methyl-1,4-dioxaspiro[4.4]nonane |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H30O2 |
| InChI |
InChI=1S/C16H30O2/c1-12(2)6-5-7-13(3)15-8-9-16(14(15)4)17-10-11-18-16/h12-15H,5-11H2,1-4H3/t13?,14-,15+/m0/s1 |
| InChIKey |
NPPDUNSGMPEZMN-NOYMGPGASA-N |
| Molecular Weight |
254.414 g/mol |
| SMILES |
C12([C@]([C@](C(CCCC(C)C)C)([H])CC2)(C)[H])OCCO1 |
| SPLASH |
splash10-0002-9000000000-fe3abeb0817438d2e81e |
| Source of Spectrum |
J-63-2330-0 |
| Wiley ID |
1258203 |
