SpectraBase Compound ID | FEWZJP0mx8c |
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InChI | InChI=1S/C21H32ClNO2/c1-13-7-8-15(21(5)12-10-16(22)19(2,3)25-21)17-14(13)9-11-20(4,24)18(17)23-6/h14-18,24H,1,7-12H2,2-5H3/t14-,15-,16-,17+,18-,20-,21?/m0/s1 |
InChIKey | WNCZWKCUIVEIGJ-IBFCIDSQSA-N |
Mol Weight | 365.9 g/mol |
Molecular Formula | C21H32ClNO2 |
Exact Mass | 365.212157 g/mol |
SpectraBase Spectrum ID | FXp4Eavq9G2 |
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Name | Kalihinol Y |
CAS Registry Number | 109979-18-2 |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C21H32ClNO2 |
InChI | InChI=1S/C21H32ClNO2/c1-13-7-8-15(21(5)12-10-16(22)19(2,3)25-21)17-14(13)9-11-20(4,24)18(17)23-6/h14-18,24H,1,7-12H2,2-5H3/t14-,15-,16-,17+,18-,20-,21?/m0/s1 |
InChIKey | WNCZWKCUIVEIGJ-IBFCIDSQSA-N |
Molecular Weight | 365.945 g/mol |
SMILES | O[C@@]1([C@]([C@]2([C@@](C3(OC(C)(C)[C@](CC3)(Cl)[H])C)(CCC([C@@]2(CC1)[H])=C)[H])[H])([N+]#[C-])[H])C |
SPLASH | splash10-03dl-6901000000-9573d9de5b355db16219 |
Source of Spectrum | C-109-6123-4 |
Wiley ID | 1351450 |