SpectraBase Spectrum ID |
4BJVbv3wR40 |
Name |
2-Methanolyl-4.beta.-n-octyl-9-anti-iodo-5-oxatricyclo[4.2.1.0(3,7)]nonane |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C17H29IO2 |
InChI |
InChI=1S/C17H29IO2/c1-2-3-4-5-6-7-8-14-15-12-9-11(13(15)10-19)16(18)17(12)20-14/h11-17,19H,2-10H2,1H3/t11?,12?,13?,14-,15?,16?,17?/m1/s1 |
InChIKey |
XTWSKJQKIQUVHZ-AXEFKARVSA-N |
Molecular Weight |
392.321 g/mol |
SMILES |
OCC1C2C(C3C(C1[C@](O3)(CCCCCCCC)[H])C2)I |
SPLASH |
splash10-000i-0090000000-df3c030fad4423f9f407 |
Source of Spectrum |
QA-44-612-10 |
Synonyms |
[(5R)-2-iodo-5-octyl-4-oxatricyclo[4.2.1.0(3,7)]non-9-yl]methanol |
Wiley ID |
862689 |