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Kaur-16-en-18-oic acid, (4.alpha.)-, o-tms
SpectraBase Compound ID H87k2puXRXr
InChI InChI=1S/C23H38O2Si/c1-16-14-23-13-10-18-21(2,19(23)9-8-17(16)15-23)11-7-12-22(18,3)20(24)25-26(4,5)6/h17-19H,1,7-15H2,2-6H3/t17-,18+,19+,21-,22-,23-/m1/s1
InChIKey STUYVKFOJUSKHG-MRNSMMEXSA-N
Mol Weight 374.6 g/mol
Molecular Formula C23H38O2Si
Exact Mass 374.264107 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BCYI3zP3Wut
Name Kaur-16-en-18-oic acid, (4.alpha.)-, o-tms
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 374.264106997 u
Formula C23H38O2Si
InChI InChI=1S/C23H38O2Si/c1-16-14-23-13-10-18-21(2,19(23)9-8-17(16)15-23)11-7-12-22(18,3)20(24)25-26(4,5)6/h17-19H,1,7-15H2,2-6H3/t17-,18+,19+,21-,22-,23-/m1/s1
InChIKey STUYVKFOJUSKHG-MRNSMMEXSA-N
Molecular Weight 374.640 g/mol
SMILES C[C@@]12[C@]3([C@]4(C[C@](CC3)([H])C(C4)=C)CC[C@@]2([C@@](C(O[Si](C)(C)C)=O)(C)CCC1)[H])[H]