| SpectraBase Spectrum ID |
4kWqnteyX2 |
| Name |
(S)-1-(3-Cyanophenyl)-2-hydroxypropan-1-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
175.063328532 u |
| Formula |
C10H9NO2 |
| GC Column |
FS-Supreme-5 (30 m x 250 micrometer) |
| GC Oven Program |
Oven temp 280oC |
| InChI |
InChI=1S/C10H9NO2/c1-7(12)10(13)9-4-2-3-8(5-9)6-11/h2-5,7,12H,1H3/t7-/m0/s1 |
| InChIKey |
SHUPSZDLLRQCDP-ZETCQYMHSA-N |
| Instrument Name |
HP 6890 GC-HP 5973 MSD |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201602084 |
| Molecular Weight |
175.187 g/mol |
| Quality |
320 |
| SMILES |
O[C@](C(C1=CC(C#N)=CC=C1)=O)(C)[H] |
| SPLASH |
splash10-001i-1900000000-c3ac4803b23ba6d2c382 |
| Source of Spectrum |
QE-22-SM18-26a (DOI: 10.1002/chem.201602084) |
| Wiley ID |
1905085 |
