| SpectraBase Spectrum ID |
ITnW9oFkz47 |
| Name |
rac-(1S,4R)-1,6-Dimethyl-4-((S)-6-methylhept-5-en-2-yl)-7-(nitromethyl)-1,2,3,4-tetrahydronaphthalene |
| Appearance |
Yellow viscous oil |
| Carrier Gas |
Hydrogen |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
329.235479240 u |
| Formula |
C21H31NO2 |
| GC Oven Program |
Oven temp 300 oC |
| InChI |
InChI=1S/C21H31NO2/c1-14(2)7-6-8-15(3)19-10-9-16(4)20-12-18(13-22(23)24)17(5)11-21(19)20/h7,11-12,15-16,19H,6,8-10,13H2,1-5H3/t15-,16-,19+/m0/s1 |
| InChIKey |
CPHUMTAQSZOMDP-TXPKVOOTSA-N |
| Instrument Name |
Agilent GC6890-HP 5973 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ejoc.202200058 |
| Molecular Weight |
329.484 g/mol |
| Quality |
183 |
| SMILES |
C1=2[C@](CC[C@](C)(C2C=C(C(C)=C1)C[N+]([O-])=O)[H])([C@](CCC=C(C)C)(C)[H])[H] |
| SPLASH |
splash10-05x3-4960000000-360d3bfd3def18a3ab95 |
| Source of Spectrum |
K1-2022-SM59-rac-SI-14 (DOI: 10.1002/ejoc.202200058) |
| Thin-Layer Chromatography |
0.6 (SiO2, cHex/EtOAc, 5:1) |
| Wiley ID |
1898724 |
