| SpectraBase Spectrum ID |
KG6iqKVmoZt |
| Name |
Ethyl (E)-4-Phenoxy-2-isocyano-3-butenoate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H13NO3 |
| InChI |
InChI=1S/C13H13NO3/c1-3-16-13(15)12(14-2)9-10-17-11-7-5-4-6-8-11/h4-10,12H,3H2,1H3/b10-9+ |
| InChIKey |
TZJUGPIXOLWTMN-MDZDMXLPSA-N |
| Molecular Weight |
231.251 g/mol |
| SMILES |
C([N+]#[C-])(C(=O)OCC)\C=C\Oc1ccccc1 |
| SPLASH |
splash10-0002-0940000000-e7b7a0114e857e37c39c |
| Source of Spectrum |
AJ-72-2311-2 |
| Synonyms |
ethyl (3E)-2-isocyano-4-phenoxybut-3-enoate |
| Wiley ID |
775240 |
