| SpectraBase Spectrum ID |
1W79SL2NUV4 |
| Name |
3-Hydroxy-3-methyl-1-(4-nitrophenoxy)butan-2-one |
| Appearance |
Colorless crystals |
| Carrier Gas |
Helium (0.7 mL/min) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
239.079372518 u |
| Formula |
C11H13NO5 |
| GC Column |
(60 m x 0.25 mm, film thickness 0.25 micrometer) |
| GC Oven Program |
Oven temp 250oC |
| InChI |
InChI=1S/C11H13NO5/c1-11(2,14)10(13)7-17-9-5-3-8(4-6-9)12(15)16/h3-6,14H,7H2,1-2H3 |
| InChIKey |
XUPWKRLYNKATKE-UHFFFAOYSA-N |
| Instrument Name |
Shimadzu GCMS-QP5050A |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3762/bjoc.18.44 |
| Molecular Weight |
239.227 g/mol |
| Quality |
86 |
| SMILES |
OC(C(=O)COC1=CC=C(C=C1)[N+]([O-])=O)(C)C |
| SPLASH |
splash10-0pb9-9500000000-76ce9111f21b77080aec |
| Source of Spectrum |
BJO-18-SM5-4d (DOI: 10.3762/bjoc.18.44) |
| Wiley ID |
1901277 |
