SpectraBase Compound ID | 9XtMtuQ12Br |
---|---|
InChI | InChI=1S/C8H11NO2/c10-5-6-3-4-9-7(6)1-2-8(9)11/h5-7H,1-4H2/t6-,7+/m1/s1 |
InChIKey | QUNHXAQCYHKALK-RQJHMYQMSA-N |
Mol Weight | 153.18 g/mol |
Molecular Formula | C8H11NO2 |
Exact Mass | 153.078979 g/mol |
SpectraBase Spectrum ID | L8kpFPiHbjv |
---|---|
Name | 1H-Pyrrolizine-1-carboxaldehyde, hexahydro-5-oxo-, trans-(.+-.)- |
CAS Registry Number | 97998-14-6 |
Comments | Edited after expert review for CH2Cl2 contamination - Original record with SpectrumID 1150399 moved to the Legacy library |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C8H11NO2 |
InChI | InChI=1S/C8H11NO2/c10-5-6-3-4-9-7(6)1-2-8(9)11/h5-7H,1-4H2/t6-,7+/m1/s1 |
InChIKey | QUNHXAQCYHKALK-RQJHMYQMSA-N |
Molecular Weight | 153.181 g/mol |
SMILES | [C@@]12(N(CC[C@@]2(C=O)[H])C(CC1)=O)[H] |
SPLASH | splash10-000b-9800000000-6d4950351b1a6c142929 |
Source of Spectrum | J-54-4348-14 |
Synonyms | (1S,7aS)-5-oxohexahydro-1H-pyrrolo[1,2-a]pyrrole-1-carbaldehyde (1S,8S)-5-ketopyrrolizidine-1-carbaldehyde (1S,8S)-5-oxidanylidene-1,2,3,6,7,8-hexahydropyrrolizine-1-carbaldehyde (1S,8S)-5-oxo-1,2,3,6,7,8-hexahydropyrrolizine-1-carbaldehyde (1S,8S)-5-oxo-1,2,3,6,7,8-hexahydropyrrolizine-1-carboxaldehyde 2-Formyl-5-azabicyclo[3.3.0]octan-6-one |
Wiley ID | 1821135 |