| SpectraBase Spectrum ID |
1TJs5X5MHko |
| Name |
trans-.beta.-Methyl-.beta.-nitrostyrene Oxide |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C9H9NO3 |
| InChI |
InChI=1S/C9H9NO3/c1-9(10(11)12)8(13-9)7-5-3-2-4-6-7/h2-6,8H,1H3/t8-,9+/m0/s1 |
| InChIKey |
CTRGNPUSQYYAAE-DTWKUNHWSA-N |
| Molecular Weight |
179.175 g/mol |
| SMILES |
[C@@]1(O[C@]1(c1ccccc1)[H])(N(=O)=O)C |
| SPLASH |
splash10-0a4i-0900000000-d10c1ab9daeada94a659 |
| Source of Spectrum |
J-63-1731-0 |
| Synonyms |
(2R,3S)-2-methyl-2-nitro-3-phenyloxirane |
| Wiley ID |
1175116 |
