| SpectraBase Spectrum ID |
8JTcC1dLr28 |
| Name |
Lanosteryl acetate |
| CAS Registry Number |
2671-68-3 |
| Classification |
Chemical |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
468.396730912 u |
| Formula |
C32H52O2 |
| InChI |
InChI=1S/C32H52O2/c1-21(2)11-10-12-22(3)24-15-19-32(9)26-13-14-27-29(5,6)28(34-23(4)33)17-18-30(27,7)25(26)16-20-31(24,32)8/h11,22,24,27-28H,10,12-20H2,1-9H3/t22-,24-,27?,28+,30-,31-,32+/m1/s1 |
| InChIKey |
BQPPJGMMIYJVBR-FBVRJMPFSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
468.766 g/mol |
| Nominal Mass |
468 u |
| Quality |
924 |
| Retention Index |
3523 |
| SMILES |
[C@]12([C@](C3=C([C@@]4(C(C([C@](CC4)(OC(=O)C)[H])(C)C)CC3)C)CC1)(CC[C@@]2([C@@](CCC=C(C)C)(C)[H])[H])C)C |
| SPLASH |
splash10-0pvl-4921100000-b56b13aeb1bb6acca8fc |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Lanosta-8,24-dien-3-betaol acetate
(1R,3aR,7S,9aS,11aR)-3a,6,6,9a,11a-pentamethyl-1-((2R)-6-methylhept-5-en-2-yl)-2,3,3a,4,5\r,5a,6,7,8,9,9a,10,11,11a-tetradecahydro-1H-cyclopenta[a]phenanthren-7-yl acetate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_015193 |
