For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
6-(Chloromethyl)-1,1,1,3,3,5-hexadeuterio-5-tosyl-6-hepten-2-one
SpectraBase Compound ID 3crfNuk4HAk
InChI InChI=1S/C15H19ClO3S/c1-11-4-7-14(8-5-11)20(18,19)15(12(2)10-16)9-6-13(3)17/h4-5,7-8,15H,2,6,9-10H2,1,3H3/i3D3,6D2,15D
InChIKey VKDJRAZXGFGKPN-AARPPZRVSA-N
Mol Weight 320.86 g/mol
Molecular Formula C15H132D6ClO3S
Exact Mass 320.112004 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID AdnsxpIdGbb
Name 6-(Chloromethyl)-1,1,1,3,3,5-hexadeuterio-5-tosyl-6-hepten-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H13D6ClO3S
InChI InChI=1S/C15H19ClO3S/c1-11-4-7-14(8-5-11)20(18,19)15(12(2)10-16)9-6-13(3)17/h4-5,7-8,15H,2,6,9-10H2,1,3H3/i3D3,6D2,15D
InChIKey VKDJRAZXGFGKPN-AARPPZRVSA-N
Molecular Weight 320.864 g/mol
SMILES C(C(C(CC(C(=C)CCl)(S(=O)(=O)c1ccc(C)cc1)[2D])([2D])[2D])=O)([2D])([2D])[2D]
SPLASH splash10-0002-9000000000-f3e4eb27ef6c031ec53a
Source of Spectrum F-50-3505-21
Wiley ID 1314815