| SpectraBase Spectrum ID |
FsD85yloOyg |
| Name |
(3S*,4R*,7S*,8S*,11S*,13S*)-8-Isocyanoamphilecta-1(12),14-diene |
| Appearance |
Colorless powder |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H31N |
| InChI |
InChI=1S/C21H31N/c1-13(2)11-17-12-15(4)18-8-7-16(5)21(22-6)10-9-14(3)19(17)20(18)21/h11,14-16,18,20H,7-10,12H2,1-5H3/t14-,15-,16-,18+,20-,21-/m0/s1 |
| InChIKey |
AUGNZYHUAYLFEB-XDBTUQKASA-N |
| Instrument Name |
Thermo Quest TSQ 700 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np030458p |
| Optical Rotation |
[a]D24 = +239.6 (c = 3.0, CHCl3) |
| Reported Formula |
C21H31N |
| SMILES |
C=1(C[C@](C)([C@@]2([C@]3(C1[C@](CC[C@]3([N+]#[C-])[C@@](C)(CC2)[H])(C)[H])[H])[H])[H])C=C(C)C |
| SPLASH |
splash10-0a4k-0190000000-c26bfa2b6be7ca163139 |
| Source of Spectrum |
G4-67-836-5 |
| Wiley ID |
1881783 |
