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Phenylbutynylphenylpropyloxirane
SpectraBase Compound ID J5bMXq7F96g
InChI InChI=1S/C21H22O/c1-2-10-20-21(22-20)19-16-9-8-15-18(19)14-7-6-13-17-11-4-3-5-12-17/h3-5,8-9,11-12,15-16,20-21H,2,6,10,13H2,1H3
InChIKey XRQJBSKJBKBTAP-UHFFFAOYSA-N
Mol Weight 290.41 g/mol
Molecular Formula C21H22O
Exact Mass 290.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ANcfSg23bv7
Name Phenylbutynylphenylpropyloxirane
Alternate Name(s) 2-(2-(4-phenylbut-1-yn-1-yl)phenyl)-3-propyloxirane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H22O
InChI InChI=1S/C21H22O/c1-2-10-20-21(22-20)19-16-9-8-15-18(19)14-7-6-13-17-11-4-3-5-12-17/h3-5,8-9,11-12,15-16,20-21H,2,6,10,13H2,1H3
InChIKey XRQJBSKJBKBTAP-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.200800385
Molecular Weight 290.406 g/mol
SMILES c1cc(C2C(O2)CCC)c(C#CCCc2ccccc2)cc1
SPLASH splash10-0ik9-2940000000-c25163b06166c345865c
Source of Spectrum ASC-350-2059/SM22-14k
Wiley ID 1765772