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tetracyclo[6.6.2.0~2,7~.0~9,14~]hexadeca-2,4,6,9,11,13-hexaen-15-ylmethyl 1-butanesulfonate
SpectraBase Compound ID Kr5gSM5MZHj
InChI InChI=1S/C21H24O3S/c1-2-3-12-25(22,23)24-14-15-13-20-16-8-4-6-10-18(16)21(15)19-11-7-5-9-17(19)20/h4-11,15,20-21H,2-3,12-14H2,1H3/t15-,20-,21+/m0/s1
InChIKey MIFSDCJEELJDTH-ONGXBYRLSA-N
Mol Weight 356.48 g/mol
Molecular Formula C21H24O3S
Exact Mass 356.144616 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FKspLrWU9Dd
Name tetracyclo[6.6.2.0~2,7~.0~9,14~]hexadeca-2,4,6,9,11,13-hexaen-15-ylmethyl 1-butanesulfonate
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/C21H24O3S/c1-2-3-12-25(22,23)24-14-15-13-20-16-8-4-6-10-18(16)21(15)19-11-7-5-9-17(19)20/h4-11,15,20-21H,2-3,12-14H2,1H3/t15-,20-,21+/m0/s1
InChIKey MIFSDCJEELJDTH-ONGXBYRLSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_17768
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: 987/00006128; Labnumber: 987/00006128218875; VK_ID: VK-017775
Temperature 308 °C