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8-Methylnoracronycine

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

8-Methylnoracronycine
SpectraBase Compound ID 17du8eNtMLV
InChI InChI=1S/C20H19NO3/c1-11-6-5-7-13-16(11)19(23)17-14(22)10-15-12(18(17)21(13)4)8-9-20(2,3)24-15/h5-10,22H,1-4H3
InChIKey CSYSIDMKPSHLMD-UHFFFAOYSA-N
Mol Weight 321.38 g/mol
Molecular Formula C20H19NO3
Exact Mass 321.136493 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 5Rx214CFxvD
Name 8-Methylnoracronycine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 321.136493473 u
Formula C20H19NO3
InChI InChI=1S/C20H19NO3/c1-11-6-5-7-13-16(11)19(23)17-14(22)10-15-12(18(17)21(13)4)8-9-20(2,3)24-15/h5-10,22H,1-4H3
InChIKey CSYSIDMKPSHLMD-UHFFFAOYSA-N
Molecular Weight 321.376 g/mol
SMILES C1(=O)C=2C(=CC=CC2N(C=2C1=C(O)C=C1C2C=CC(C)(C)O1)C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.95339