| SpectraBase Spectrum ID |
DGoKWaIjFrw |
| Name |
2,5-Dimethyl-2RS-(4R,8R,12-trimethyldecan-1-yl)-6-acetoxy-benzo[h]chromane |
| Carrier Gas |
Helium |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
494.375995467 u |
| Formula |
C33H50O3 |
| InChI |
InChI=1S/C33H50O3/c1-23(2)13-10-14-24(3)15-11-16-25(4)17-12-21-33(7)22-20-28-26(5)31(35-27(6)34)29-18-8-9-19-30(29)32(28)36-33/h8-9,18-19,23-25H,10-17,20-22H2,1-7H3/t24-,25-,33?/m1/s1 |
| InChIKey |
JUQBZXGRKDRHAJ-AAKKKFBHSA-N |
| Instrument Name |
Finnigan MAT 8200 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3998/ark.5550190.0004.d11 |
| Molecular Weight |
494.760 g/mol |
| Optical Rotation |
[a]D18 = +1.1 (c = 1.34, CHCl3) |
| Quality |
154 |
| SMILES |
C1=CC2=C(C=C1)C1=C(C(=C2OC(C)=O)C)CCC(O1)(C)CCC[C@@](CCC[C@@](CCCC(C)C)(C)[H])(C)[H] |
| SPLASH |
splash10-0udu-3500900000-d5f80fcbfcda888f7ef3 |
| Source of Spectrum |
ARK-2003-110-8 (DOI: 10.3998/ark.5550190.0004.d11) |
| Wiley ID |
1899767 |
![2,5-Dimethyl-2RS-(4R,8R,12-trimethyldecan-1-yl)-6-acetoxy-benzo[h]chromane](/api/spectrum/DGoKWaIjFrw/structure.png?h=300&w=458 "2,5-Dimethyl-2RS-(4R,8R,12-trimethyldecan-1-yl)-6-acetoxy-benzo[h]chromane")
