SpectraBase Compound ID | 2GMYYZawbcr |
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InChI | InChI=1S/C18H20N2O3S/c1-19-17(13-8-4-3-5-9-13)18(23-24(2,21)22)16-12-14-10-6-7-11-15(14)20(16)19/h3-11,16-18H,12H2,1-2H3/t16-,17+,18-/m0/s1 |
InChIKey | STTZWORPLNRGQU-KSZLIROESA-N |
Mol Weight | 344.43 g/mol |
Molecular Formula | C18H20N2O3S |
Exact Mass | 344.119464 g/mol |
SpectraBase Spectrum ID | 29OLN1Wujs9 |
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Name | (2R,3S,3aS)-1-Methyl-2-phenyl-2,3,3a,4-tetrahydro-1H-pyrazolo[1,5-a]indole-3-yl methanesulfonate |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C18H20N2O3S |
InChI | InChI=1S/C18H20N2O3S/c1-19-17(13-8-4-3-5-9-13)18(23-24(2,21)22)16-12-14-10-6-7-11-15(14)20(16)19/h3-11,16-18H,12H2,1-2H3/t16-,17+,18-/m0/s1 |
InChIKey | STTZWORPLNRGQU-KSZLIROESA-N |
Molecular Weight | 344.429 g/mol |
SMILES | [C@]1(N(N2[C@]([C@@]1(OS(=O)(=O)C)[H])(Cc1c2cccc1)[H])C)(c1ccccc1)[H] |
SPLASH | splash10-00ke-2912000000-7fa69863ebccd5e3e90e |
Source of Spectrum | KC-0-1873-5 |
Synonyms | (2R,3S,3aS)-1-methyl-2-phenyl-2,3,3a,4-tetrahydro-1H-pyrazolo[1,5-a]indol-3-yl methanesulfonate (2RS,3SR,3aSR)-1-Methyl-2-phenyl-2,3,3a,4-tetrahydro-1H-pyrazolo[1,5-a]indole-3-yl methanesulfonate Methanesulfonic acid[(2R,3S,3aS)-1-methyl-2-phenyl-2,3,3a,4-tetrahydropyrazolo[1,5-a]indol-3-yl]ester Methanesulfonic acid[(2R,3S,3aS)-1-methyl-2-phenyl-2,3,3a,4-tetrahydropyrazol[1,5-a]indol-3-yl]ester [(2R,3S,3aS)-1-methyl-2-phenyl-2,3,3a,4-tetrahydropyrazolo[1,5-a]indol-3-yl]methanesulfonate Methanesulfonic acid [(2R,3S,3aS)-1-methyl-2-phenyl-2,3,3a,4-tetrahydropyrazolo[1,5-a]indol-3-yl] ester [(2R,3S,3aS)-1-methyl-2-phenyl-2,3,3a,4-tetrahydropyrazolo[1,5-a]indol-3-yl] methanesulfonate |
Wiley ID | 781505 |