| SpectraBase Spectrum ID |
6xihDT84kWl |
| Name |
D-1,2-anhydro-5,6-O-isopropylidene-allo-inositol |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C9H14O5 |
| InChI |
InChI=1S/C9H14O5/c1-9(2)13-6-4(11)3(10)5-7(12-5)8(6)14-9/h3-8,10-11H,1-2H3/t3-,4+,5-,6-,7-,8-/m1/s1 |
| InChIKey |
XGNLUOKMXFGWEF-XAZAIFFQSA-N |
| Instrument Name |
Shimadzu GC??MS-QP2010 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ejoc.201801424 |
| Molecular Weight |
202.206 g/mol |
| Optical Rotation |
(a)D21.5 = +22 (c = 1.41, MeOH) |
| Reported Formula |
C9H14O5 |
| SMILES |
O[C@]1([C@]([C@@]2([C@]([C@]3([C@@]1(OC(O3)(C)C)[H])[H])(O2)[H])[H])(O)[H])[H] |
| SPLASH |
splash10-05a9-5900000000-7750eeec02f20987a29e |
| Source of Spectrum |
U1-2019-797-15 |
| Wiley ID |
1843686 |
