| SpectraBase Spectrum ID |
F8DsW37lgN0 |
| Name |
1-[(11S)-3.beta.-Hydroxyeudesma-4,6-dien-12-yl]piperidine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
303.256214686 u |
| Formula |
C20H33NO |
| InChI |
InChI=1S/C20H33NO/c1-15(14-21-11-5-4-6-12-21)17-7-9-20(3)10-8-19(22)16(2)18(20)13-17/h13,15,19,22H,4-12,14H2,1-3H3/t15-,19+,20+/m1/s1 |
| InChIKey |
MTSYVRKFKSHQAH-XPGWFJOJSA-N |
| SMILES |
C1=2C=C([C@@](CN3CCCCC3)(C)[H])CC[C@]1(CC[C@@](C2C)(O)[H])C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.940521 |