| SpectraBase Spectrum ID |
GQD5u6FDVLD |
| Name |
meso-1,2,3,4,6-penta-O-acetyl-5-azido-5-deoxy-neo-inositol |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H21N3O10 |
| InChI |
InChI=1S/C16H21N3O10/c1-6(20)25-12-11(18-19-17)13(26-7(2)21)15(28-9(4)23)16(29-10(5)24)14(12)27-8(3)22/h11-16H,1-5H3/t11-,12+,13-,14-,15+,16- |
| InChIKey |
MHRSYSZNHBEFKB-YGRRVBNWSA-N |
| Instrument Name |
Shimadzu GC??MS-QP2010 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ejoc.201801424 |
| Molecular Weight |
415.355 g/mol |
| Optical Rotation |
(a)D21.5 = 0 (c = 0.67, MeOH) |
| Reported Formula |
C16H21N3O10 |
| SMILES |
[C@@]1([C@@](OC(C)=O)([C@]([C@@](OC(=O)C)([C@](OC(C)=O)([C@@]1(N=[N+]=[N-])[H])[H])[H])(OC(=O)C)[H])[H])(OC(=O)C)[H] |
| SPLASH |
splash10-0159-0910000000-d8d166882ade39c1c430 |
| Source of Spectrum |
U1-2019-799-22 |
| Wiley ID |
1843692 |
