| SpectraBase Spectrum ID |
9OOoZt8XrYi |
| Name |
(R)-9a-propylhexahydro-5H-pyrrolo[1,2-a]azepine-5,9(6H)-dione |
| Appearance |
Colourless liquid |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
209.141578854 u |
| Formula |
C12H19NO2 |
| InChI |
InChI=1S/C12H19NO2/c1-2-7-12-8-4-9-13(12)11(15)6-3-5-10(12)14/h2-9H2,1H3/t12-/m1/s1 |
| InChIKey |
IGGZMOJAZPITGN-GFCCVEGCSA-N |
| Instrument Name |
Shimadzu GCMSQP2010SE |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.202107909 |
| Molecular Weight |
209.289 g/mol |
| Optical Rotation |
[a]D28 = 108 (c = 1.0, CHCl3) |
| Quality |
235 |
| SMILES |
C1CCC(N2[C@@](C1=O)(CCC2)CCC)=O |
| SPLASH |
splash10-08g0-3900000000-abf8d4e246eaa4258868 |
| Sample Comments |
91% ee |
| Source of Spectrum |
ACI-60-SM55-2m (DOI: 10.1002/anie.202107909) |
| Wiley ID |
1891360 |
![(R)-9a-propylhexahydro-5H-pyrrolo[1,2-a]azepine-5,9(6H)-dione](/api/spectrum/9OOoZt8XrYi/structure.png?h=300&w=458 "(R)-9a-propylhexahydro-5H-pyrrolo[1,2-a]azepine-5,9(6H)-dione")
