| SpectraBase Spectrum ID |
6te5ergsZlM |
| Name |
2,3-bis-Endo-(1',beta.,1'.beta.-di-N-pentanolyl)bicyclo[2.2.1]-5-heptene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
266.224580204 u |
| Formula |
C17H30O2 |
| InChI |
InChI=1S/C17H30O2/c1-3-5-7-14(18)16-12-9-10-13(11-12)17(16)15(19)8-6-4-2/h9-10,12-19H,3-8,11H2,1-2H3/t12-,13+,14+,15-,16+,17- |
| InChIKey |
LQZNPMKKLBUHOV-PUWUPWDNSA-N |
| Molecular Weight |
266.425 g/mol |
| SMILES |
[C@]12([C@]([C@@]([C@](O)(CCCC)[H])([C@](C2)(C=C1)[H])[H])([C@@](O)(CCCC)[H])[H])[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.943527 |
![2,3-Bis-endo-(1',beta.,1'.beta.-di-n-pentanolyl)bicyclo[2.2.1]-5-heptene](/api/spectrum/6te5ergsZlM/structure.png?h=300&w=458 "2,3-Bis-endo-(1',beta.,1'.beta.-di-n-pentanolyl)bicyclo[2.2.1]-5-heptene")
