Common Name: 1-Oxo-2,3-dihydro-1H-pyrrolizine-7-carbaldehyde
Synonyms: 1-Oxo-2,3-dihydro-1H-pyrrolizine-7-carbaldehyde
CAS Registry Number:
InChI: InChI=1S/C8H7NO2/c10-5-6-1-3-9-4-2-7(11)8(6)9/h1,3,5H,2,4H2
InChIKey: InChIKey=PMACSXXWMPSEIU-UHFFFAOYSA-N
Formula: C8H7N1O2
Molecular Weight: 149.147025
Exact Mass: 149.047678
NMR Solvent: CD3OD
MHz:
Calibration:
NMR references: 13C - Xu, F.Q., Liu, H.Y., Chen, C.X., Zhong, H.M. Chem Nat Compd (2008) 44, 308-10
Species:
Notes: Family : Alkaloids, Type : Pyrrolizidines; 13 C Spectrum from Naproc 13: José Luis López-Pérez, Roberto Therón, Esther del Olmo, David Díaz: NAPROC-13: a database for the dereplication of natural product mixtures in bioassay-guided protocols. Bioinformatics 23(23):3256-3257 (2007)
Position | PPM |
---|---|
1 (C) | 123 |
2 (CH) | 115.7 |
3 (CH) | 123 |
5 (CH2) | 43.2 |
6 (CH2) | 39.3 |
7 (C) | 189.1 |
7a (C) | 135.1 |
8 (CH) | 183.9 |