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5-Acetoxy-4-(1H-pyrazole-1-yl)[2.2]paracyclophane
SpectraBase Compound ID 7y3un5D4pu9
InChI InChI=1S/C21H20N2O2/c1-15(24)25-21-19-10-8-17-5-3-16(4-6-17)7-9-18(11-12-19)20(21)23-14-2-13-22-23/h2-6,11-14H,7-10H2,1H3
InChIKey QFRXUTIQTCYHAS-UHFFFAOYSA-N
Mol Weight 332.4 g/mol
Molecular Formula C21H20N2O2
Exact Mass 332.152478 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EPoZylmhQcL
Name 5-Acetoxy-4-(1H-pyrazole-1-yl)[2.2]paracyclophane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H20N2O2
InChI InChI=1S/C21H20N2O2/c1-15(24)25-21-19-10-8-17-5-3-16(4-6-17)7-9-18(11-12-19)20(21)23-14-2-13-22-23/h2-6,11-14H,7-10H2,1H3
InChIKey QFRXUTIQTCYHAS-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201200625
Molecular Weight 332.403 g/mol
SMILES c1cc2ccc1CCc1c(c(OC(C)=O)c(CC2)cc1)-[n]1nccc1
SPLASH splash10-0019-0926000000-dbad949f0a68d8db93da
Source of Spectrum ASC-354-3246-14
Wiley ID 1762826