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(3bS,4aR)-1-(4-chlorobenzoyl)-3,4,4-trimethyl-3b,4,4a,5-tetrahydro-1H-cyclopropa[3,4]cyclopenta[1,2-c]pyrazole
SpectraBase Compound ID GnzLgtk38NL
InChI InChI=1S/C17H17ClN2O/c1-9-14-13(8-12-15(14)17(12,2)3)20(19-9)16(21)10-4-6-11(18)7-5-10/h4-7,12,15H,8H2,1-3H3
InChIKey WCRSDFKKXAVCQJ-UHFFFAOYSA-N
Mol Weight 300.79 g/mol
Molecular Formula C17H17ClN2O
Exact Mass 300.102941 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ECTIih7IMwN
Name (3bS,4aR)-1-(4-chlorobenzoyl)-3,4,4-trimethyl-3b,4,4a,5-tetrahydro-1H-cyclopropa[3,4]cyclopenta[1,2-c]pyrazole
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C17H17ClN2O/c1-9-14-13(8-12-15(14)17(12,2)3)20(19-9)16(21)10-4-6-11(18)7-5-10/h4-7,12,15H,8H2,1-3H3
InChIKey WCRSDFKKXAVCQJ-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_10005
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: 133019; Labnumber: NC98RN83-167; VK_ID: VK-010009
Temperature 308 °C