| SpectraBase Spectrum ID |
JyZYvzU7RKD |
| Name |
Aminocarbasugar |
| Alternate Name(s) |
ethyl (3aR,4S,5R,7aS)-4-hydroxy-5-(hydroxymethyl)-2,2-dimethylhexahydro-1,3-benzoxazole-3(2H)-carboxylate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H23NO5 |
| InChI |
InChI=1S/C13H23NO5/c1-4-18-12(17)14-10-9(19-13(14,2)3)6-5-8(7-15)11(10)16/h8-11,15-16H,4-7H2,1-3H3/t8-,9+,10+,11+/m1/s1 |
| InChIKey |
QYDHCYFZRSTYKZ-RCWTZXSCSA-N |
| Molecular Weight |
273.329 g/mol |
| SMILES |
OC[C@]1(CC[C@@]2(OC(N([C@@]2([C@]1(O)[H])[H])C(=O)OCC)(C)C)[H])[H] |
| SPLASH |
splash10-0a4i-0090000000-d3b83c3c926e4e286801 |
| Source of Spectrum |
J-64-9624-40 |
| Wiley ID |
1531834 |
