| SpectraBase Spectrum ID |
WNLB8w6FPq |
| Name |
Isorhynchophylline |
| CAS Registry Number |
6859-01-4 |
| Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
384.204907386 u |
| Formula |
C22H28N2O4 |
| GC Column |
HP-5ms (30 m × 0.25 mm ID x 0.25 μm film thickness) |
| InChI |
InChI=1S/C22H28N2O4/c1-4-14-12-24-10-9-22(17-7-5-6-8-18(17)23-21(22)26)19(24)11-15(14)16(13-27-2)20(25)28-3/h5-8,13-15,19H,4,9-12H2,1-3H3,(H,23,26)/b16-13+/t14-,15-,19-,22-/m0/s1 |
| InChIKey |
DAXYUDFNWXHGBE-VKCGGMIFSA-N |
| Molecular Weight |
384.476 g/mol |
| Nominal Mass |
384 u |
| Number of Peaks |
243 |
| SMILES |
N1c2c([C@]3(C1=O)[C@]1(N(CC3)C[C@@]([C@](C1)(\C(C(OC)=O)=C/OC)[H])(CC)[H])[H])cccc2 |
| SPLASH |
splash10-001r-7953000000-ca5ecb1b6ef3f0415d0c |
| Source |
Uncaria tomentosa |
| Source of Spectrum |
Biologically and Environmentally Important Organic Compounds: GCMS Library |
| Wiley ID |
VI001712 |
