| SpectraBase Spectrum ID |
1WBj1x7HZg |
| Name |
D-3,4,6-tri-O-acetyl-5-azido-5-deoxy-1,2-O-isopropyliden-neoinositol |
| Appearance |
Colourless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H21N3O8 |
| InChI |
InChI=1S/C15H21N3O8/c1-6(19)22-10-9(17-18-16)11(23-7(2)20)13-14(12(10)24-8(3)21)26-15(4,5)25-13/h9-14H,1-5H3/t9-,10+,11-,12-,13+,14-/m1/s1 |
| InChIKey |
KHXGSUAIQYROKP-CLHCLYRXSA-N |
| Instrument Name |
Shimadzu GC??MS-QP2010 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ejoc.201801424 |
| Molecular Weight |
371.346 g/mol |
| Optical Rotation |
(a)D21.5 = ?8 (c = 0.91, MeOH) |
| Reported Formula |
C15H21N3O8 |
| SMILES |
[C@]1(OC(C)=O)([C@]([C@]2(OC(O[C@]2([C@@]([C@@]1(N=[N+]=[N-])[H])(OC(=O)C)[H])[H])(C)C)[H])(OC(=O)C)[H])[H] |
| SPLASH |
splash10-0600-0901000000-5f9f70d77b1b5d093b18 |
| Source of Spectrum |
U1-2019-798-21 |
| Wiley ID |
1843691 |
