| SpectraBase Spectrum ID |
Iw9f1sI7EJi |
| Name |
Oxiranemethanol, .alpha.-methyl-, 3,5-dinitrobenzoate, (R*,R*)- |
| Alternate Name(s) |
(1R)-1-[(2R)-oxiranyl]ethyl 3,5-dinitrobenzoate
syn(threo)-3,4-epoxybut-2-yl 3,5-dinitrobenzoate |
| CAS Registry Number |
126822-47-7 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H10N2O7 |
| InChI |
InChI=1S/C11H10N2O7/c1-6(10-5-19-10)20-11(14)7-2-8(12(15)16)4-9(3-7)13(17)18/h2-4,6,10H,5H2,1H3/t6-,10-/m1/s1 |
| InChIKey |
SWWMOHFNBIWPEY-LHLIQPBNSA-N |
| Molecular Weight |
282.208 g/mol |
| SMILES |
c1(N(=O)=O)cc(N(=O)=O)cc(C(O[C@@]([C@@]2(OC2)[H])(C)[H])=O)c1 |
| SPLASH |
splash10-0002-0900000000-122cc658336b88e822ac |
| Source of Spectrum |
C-112-3538-12 |
| Wiley ID |
1285342 |
