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Benzoylecgonine TMS
SpectraBase Compound ID F90rlaqkTby
InChI InChI=1S/C19H27NO4Si/c1-20-14-10-11-15(20)17(19(22)24-25(2,3)4)16(12-14)23-18(21)13-8-6-5-7-9-13/h5-9,14-17H,10-12H2,1-4H3/t14-,15+,16-,17+/m1/s1
InChIKey XJVQJFLZKCKXME-TWMKSMIVSA-N
Mol Weight 361.51 g/mol
Molecular Formula C19H27NO4Si
Exact Mass 361.170935 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1VaziE13gLA
Name BENZOYLECGONINE-TMS
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C19H27NO4Si
InChI InChI=1S/C19H27NO4Si/c1-20-14-10-11-15(20)17(19(22)24-25(2,3)4)16(12-14)23-18(21)13-8-6-5-7-9-13/h5-9,14-17H,10-12H2,1-4H3/t14-,15+,16-,17+/m1/s1
InChIKey XJVQJFLZKCKXME-TWMKSMIVSA-N
Instrument Name GC
Molecular Weight 361.513 g/mol
SMILES C1C[C@]2(N(C)[C@@]1([C@](C(O[Si](C)(C)C)=O)([C@](OC(c1ccccc1)=O)(C2)[H])[H])[H])[H]
SPLASH splash10-001i-9220000000-0200fc2b3027b1ac0494
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany