SpectraBase Spectrum ID |
77n3oNnRu16 |
Name |
(S)-8a-(2-methylallyl)hexahydroindolizine-5,8-dione |
Appearance |
Colourless liquid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
207.125928789 u |
Formula |
C12H17NO2 |
InChI |
InChI=1S/C12H17NO2/c1-9(2)8-12-6-3-7-13(12)11(15)5-4-10(12)14/h1,3-8H2,2H3/t12-/m0/s1 |
InChIKey |
RLMCQVOGYFXCIT-LBPRGKRZSA-N |
Instrument Name |
Shimadzu GCMSQP2010SE |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/anie.202107909 |
Molecular Weight |
207.273 g/mol |
Optical Rotation |
[a]D27 = 250 (c = 1.0, CHCl3) |
Quality |
185 |
SMILES |
C1C([C@@]2(N(C(C1)=O)CCC2)CC(=C)C)=O |
SPLASH |
splash10-0ab9-9500000000-921ce5b12bd7affa6701 |
Sample Comments |
98% ee |
Source of Spectrum |
ACI-60-SM65-4p (DOI: 10.1002/anie.202107909) |
Wiley ID |
1891394 |