| SpectraBase Spectrum ID |
LJUeTFNfzlO |
| Name |
1-[(11S)-3.beta.-Hydroxyeudesma-4,6-dien-12-yl]pyrrolidine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
289.240564621 u |
| Formula |
C19H31NO |
| InChI |
InChI=1S/C19H31NO/c1-14(13-20-10-4-5-11-20)16-6-8-19(3)9-7-18(21)15(2)17(19)12-16/h12,14,18,21H,4-11,13H2,1-3H3/t14?,18-,19-/m0/s1 |
| InChIKey |
HLDCGYHBMASTGB-SQJZIBIZSA-N |
| Molecular Weight |
289.463 g/mol |
| SMILES |
C1=2C=C(C(CN3CCCC3)C)CC[C@]1(CC[C@@](C2C)(O)[H])C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.94011 |