| SpectraBase Spectrum ID |
7i6YzSeewWM |
| Name |
BINAPACRYL |
| CAS Registry Number |
485-31-4 |
| Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
322.116486302 u |
| Formula |
C15H18N2O6 |
| InChI |
InChI=1S/C15H18N2O6/c1-5-10(4)12-7-11(16(19)20)8-13(17(21)22)15(12)23-14(18)6-9(2)3/h6-8,10H,5H2,1-4H3 |
| InChIKey |
ZRDUSMYWDRPZRM-UHFFFAOYSA-N |
| Molecular Weight |
322.317 g/mol |
| Nominal Mass |
322 u |
| Number of Peaks |
95 |
| SMILES |
c1(cc(c(c(c1)C(C)CC)OC(=O)C=C(C)C)[N+](=O)[O-])[N+](=O)[O-] |
| SPLASH |
splash10-001i-9230000000-c6101347456496a98324 |
| Source of Spectrum |
Dr. Rolf Kuehnle |
| Synonyms |
(RS)-2-sec-butyl-4,6-dinitrophenyl 3-methylcrotonate
2-sec-butyl-4,6-dinitrophenyl 3-methyl-2-butenoate
2-(1-methylpropyl)-4,6-dinitrophenyl 3-methyl-2-butenoate |
| Technique |
GC-CI-MODE |
| Wiley ID |
WID_MSPA_3300 |
