| SpectraBase Spectrum ID |
IzZVmhsok7V |
| Name |
(1S,2S)-2-(phenoxymethyl)cyclopropane-1-carbonitrile |
| Appearance |
Brown liquid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
173.084063977 u |
| Formula |
C11H11NO |
| InChI |
InChI=1S/C11H11NO/c12-7-9-6-10(9)8-13-11-4-2-1-3-5-11/h1-5,9-10H,6,8H2/t9-,10-/m1/s1 |
| InChIKey |
NPTXWZQNZXCTLB-NXEZZACHSA-N |
| Instrument Name |
Shimadzu GC-2010 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201810059 |
| Molecular Weight |
173.215 g/mol |
| Quality |
63 |
| SMILES |
C([C@@]1([C@](C1)(C#N)[H])[H])OC1=CC=CC=C1 |
| SPLASH |
splash10-0ab9-0900000000-745c5814f5d717887e64 |
| Sample Comments |
>99% de, 31% ee |
| Source of Spectrum |
ACI-57-SM36-5b (DOI: 10.1002/anie.201810059) |
| Wiley ID |
1893635 |
