| SpectraBase Spectrum ID |
ChP4WbqLrbp |
| Name |
4A(2H)-Naphthalenecarboxylic acid, 1-[2-(3-furanyl)ethyl]-1,3,4,7,8,8A-hexahydro-4-hydroxy-1,2,5-trimethyl-, methyl ester, [1S-(1.alpha.,2.beta.,4.beta.,4A.beta.,8A.alpha.)]- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
346.214409442 u |
| Formula |
C21H30O4 |
| InChI |
InChI=1S/C21H30O4/c1-14-6-5-7-17-20(3,10-8-16-9-11-25-13-16)15(2)12-18(22)21(14,17)19(23)24-4/h6,9,11,13,15,17-18,22H,5,7-8,10,12H2,1-4H3/t15-,17-,18+,20-,21-/m0/s1 |
| InChIKey |
HBUIVUNNEKOVHP-WJLOEWIOSA-N |
| Molecular Weight |
346.467 g/mol |
| SMILES |
[C@]12([C@]([C@](CCC3=COC=C3)(C)[C@](C[C@]1(O)[H])(C)[H])(CCC=C2C)[H])C(=O)OC |
![4a(2H)-Naphthalenecarboxylic acid, 1-[2-(3-furanyl)ethyl]-1,3,4,7,8,8a-hexahydro-4-hydroxy-1,2,5-trimethyl-, methyl ester, [1S-(1.alpha.,2.beta.,4.beta.,4a.beta.,8a.alpha.)]-](/api/spectrum/ChP4WbqLrbp/structure.png?h=300&w=458 "4a(2H)-Naphthalenecarboxylic acid, 1-[2-(3-furanyl)ethyl]-1,3,4,7,8,8a-hexahydro-4-hydroxy-1,2,5-trimethyl-, methyl ester, [1S-(1.alpha.,2.beta.,4.beta.,4a.beta.,8a.alpha.)]-")
