SpectraBase Compound ID | BUfoKjyBKkH |
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InChI | InChI=1S/C32H52O2/c1-21(33)34-26-15-17-29(6)22-14-18-32(9)25-11-10-16-27(2,3)31(25,8)20-19-30(32,7)23(22)12-13-24(29)28(26,4)5/h14,23-26H,10-13,15-20H2,1-9H3/t23?,24?,25-,26+,29-,30-,31+,32+/m1/s1 |
InChIKey | UAUCHCSYYNBVAC-LRYNAZNHSA-N |
Mol Weight | 468.8 g/mol |
Molecular Formula | C32H52O2 |
Exact Mass | 468.396731 g/mol |
SpectraBase Spectrum ID | 3HmMxQyORs |
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Name | Swert-9(11)-en-3.beta.-yl acetate |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C32H52O2 |
InChI | InChI=1S/C32H52O2/c1-21(33)34-26-15-17-29(6)22-14-18-32(9)25-11-10-16-27(2,3)31(25,8)20-19-30(32,7)23(22)12-13-24(29)28(26,4)5/h14,23-26H,10-13,15-20H2,1-9H3/t23?,24?,25-,26+,29-,30-,31+,32+/m1/s1 |
InChIKey | UAUCHCSYYNBVAC-LRYNAZNHSA-N |
Molecular Weight | 468.766 g/mol |
SMILES | C=12[C@@]3(C(C(C)(C)[C@](CC3)(OC(=O)C)[H])CCC2[C@]2(CC[C@]3([C@]([C@@]2(CC1)C)(CCCC3(C)C)[H])C)C)C |
SPLASH | splash10-0uy3-0096400000-eaa659defa6848b3d762 |
Source of Spectrum | E1-40-1687-0 |
Wiley ID | 1519566 |