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7-D3-suberosin
SpectraBase Compound ID 3GknqxIr7KT
InChI InChI=1S/C15H16O3/c1-10(2)4-5-11-8-12-6-7-15(16)18-14(12)9-13(11)17-3/h4,6-9H,5H2,1-3H3/i3D3
InChIKey RSZDAYHEZSRVHS-HPRDVNIFSA-N
Mol Weight 247.31 g/mol
Molecular Formula C15H132D3O3
Exact Mass 247.128775 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L0BDsoDxFdK
Name 7-D3-suberosin
CAS Registry Number 38409-35-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H13D3O3
InChI InChI=1S/C15H16O3/c1-10(2)4-5-11-8-12-6-7-15(16)18-14(12)9-13(11)17-3/h4,6-9H,5H2,1-3H3/i3D3
InChIKey RSZDAYHEZSRVHS-HPRDVNIFSA-N
Molecular Weight 247.308 g/mol
SMILES c12OC(=O)C=Cc2cc(CC=C(C)C)c(c1)OC([2D])([2D])[2D]
SPLASH splash10-001j-1390000000-80b493ce6713a0624f4d
Source of Spectrum O-6-1018-5
Wiley ID 33877