| SpectraBase Spectrum ID |
7a3fDLG7pnD |
| Name |
1H-Indene-4-methanol, 1-(1,5-dimethylhexyl)-2,3,3a,6,7,7a-hexahydro-7a-methyl-, 4-nitrobenzoate, [1R-[1.alpha.(R*),3a.beta.,7a.alpha.]]- |
| CAS Registry Number |
3752-57-6 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C26H37NO4 |
| InChI |
InChI=1S/C26H37NO4/c1-18(2)7-5-8-19(3)23-14-15-24-21(9-6-16-26(23,24)4)17-31-25(28)20-10-12-22(13-11-20)27(29)30/h9-13,18-19,23-24H,5-8,14-17H2,1-4H3/t19?,23-,24+,26-/m1/s1 |
| InChIKey |
STCCLLYZOINCRB-WZNDQLEHSA-N |
| Molecular Weight |
427.585 g/mol |
| SMILES |
[C@]12([C@](C(COC(c3ccc(N(=O)=O)cc3)=O)=CCC1)(CC[C@@]2(C(CCCC(C)C)C)[H])[H])C |
| SPLASH |
splash10-0002-0940000000-e1b9e31e4bac0304291f |
| Source of Spectrum |
I-64-1542-12 |
| Synonyms |
4-Indanmethanol, 1.beta.-(1,5-dimethylhexyl)-3a.alpha.,6,7,7a-tetrahydro-7a.beta.-methyl-, p-nitrobenzoate
p-Nitrobenzoate
[(1R,3aR,7aR)-1-(1,5-dimethylhexyl)-7a-methyl-2,3,3a,6,7,7a-hexahydro-1H-inden-4-yl]methyl 4-nitrobenzoate |
| Wiley ID |
1380447 |
![1H-Indene-4-methanol, 1-(1,5-dimethylhexyl)-2,3,3a,6,7,7a-hexahydro-7a-methyl-, 4-nitrobenzoate, [1R-[1.alpha.(R*),3a.beta.,7a.alpha.]]-](/api/spectrum/7a3fDLG7pnD/structure.png?h=300&w=458 "1H-Indene-4-methanol, 1-(1,5-dimethylhexyl)-2,3,3a,6,7,7a-hexahydro-7a-methyl-, 4-nitrobenzoate, [1R-[1.alpha.(R*),3a.beta.,7a.alpha.]]-")
