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1-((3aR,6aS)-6a-Ethyl-2-phenyl-tetrahydro-cyclopenta[1,3,2]dioxaborol-3a-yl)-propan-1-one
SpectraBase Compound ID 9csG3n1WiRe
InChI InChI=1S/C16H21BO3/c1-3-14(18)16-12-8-11-15(16,4-2)19-17(20-16)13-9-6-5-7-10-13/h5-7,9-10H,3-4,8,11-12H2,1-2H3/t15-,16-/m0/s1
InChIKey CWPGMDWDZFHRHP-HOTGVXAUSA-N
Mol Weight 272.2 g/mol
Molecular Formula C16H21BO3
Exact Mass 272.158375 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7VFvRnhWZCu
Name 1-((3aR,6aS)-6a-Ethyl-2-phenyl-tetrahydro-cyclopenta[1,3,2]dioxaborol-3a-yl)-propan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H21BO3
InChI InChI=1S/C16H21BO3/c1-3-14(18)16-12-8-11-15(16,4-2)19-17(20-16)13-9-6-5-7-10-13/h5-7,9-10H,3-4,8,11-12H2,1-2H3/t15-,16-/m0/s1
InChIKey CWPGMDWDZFHRHP-HOTGVXAUSA-N
Molecular Weight 272.151 g/mol
SMILES [C@@]12(OB(c3ccccc3)O[C@]1(CCC2)CC)C(=O)CC
SPLASH splash10-02t9-0290000000-f88e73546d46b3df8b1b
Source of Spectrum F4-43-1539-3d
Synonyms 6a-Ethyl-2-phenyl-3a-propanoyl-4H-tetrahydrocyclopenta[1,3,2]dioxaborole
Wiley ID 1690843