N-Formylloline

N-Formylloline

Common Name: N-Formylloline

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C9H14N2O2/c1-10(5-12)6-4-8-11-3-2-7(13-8)9(6)11/h5-9H,2-4H2,1H3/t6?,7-,8-,9?/m0/s1

InChIKey: InChIKey=SKZANWVOGCEFBY-QXNPHUFVSA-N

Formula: C9H14N2O2

Molecular Weight: 182.22009

Exact Mass: 182.105528

NMR Solvent: W+W

MHz:

Calibration:

NMR references: 13C - Blankenship, J.D., Spiering, M.J., Wilkinson, H.H., Fannin, F.F., Bush, L.P., Schardl, C.L. Phytochemistry (2001) 58, 395-401

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)

Carbon NMR Peaks

Position PPM
1 (CH) 63
2 (CH2) 73.5
3 (CH) 60.6
5 (CH2) 54.3
6 (CH2) 31.7
7 (CH) 81.4
8 (CH) 68.6
1a (CH) 30.4
1b (CH3) 167