SpectraBase Spectrum ID |
19vgUe7ti7W |
Name |
(3aR*, 9bS*)-1,2,3a,4,5,9b-Hexahydro-8-methoxylnaphtho[2,1-b]furan |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
204.115029753 u |
Formula |
C13H16O2 |
GC Column |
(25 m ?? 0.25 mm, film thickness 0.25 micrometer) |
GC Oven Program |
Oven temp 170 oC |
InChI |
InChI=1S/C13H16O2/c1-14-10-4-2-9-3-5-13-11(6-7-15-13)12(9)8-10/h2,4,8,11,13H,3,5-7H2,1H3/t11-,13+/m1/s1 |
InChIKey |
NDLLICYUNBSXQP-YPMHNXCESA-N |
Instrument Name |
Chirasil-DEX-CB |
Ionization Type |
EI positive ion |
Literature Reference DOI |
10.1002/anie.201609110 |
Molecular Weight |
204.269 g/mol |
Optical Rotation |
[a]D20 = +101.5 (c = 0.52, CHCl3) |
Quality |
31 |
SMILES |
C1(=CC2=C(C=C1)CC[C@]1([C@@]2(CCO1)[H])[H])OC |
SPLASH |
splash10-0pb9-0940000000-9255b9c985a91916d4ac |
Sample Comments |
78% ee |
Source of Spectrum |
ACI-55-SM18-2b (DOI: 10.1002/anie.201609110) |
Wiley ID |
1899385 |