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1-(Hex-5-enyl)-4-isopropyl-5-methoxy-1,2-dihydrobenzocyclobutene-1-carbonitrile
SpectraBase Compound ID 5e1CtoINXeY
InChI InChI=1S/C19H25NO/c1-5-6-7-8-9-19(13-20)12-15-10-16(14(2)3)18(21-4)11-17(15)19/h5,10-11,14H,1,6-9,12H2,2-4H3
InChIKey GMJTWQROQSUOKF-UHFFFAOYSA-N
Mol Weight 283.41 g/mol
Molecular Formula C19H25NO
Exact Mass 283.193614 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7jaBLEDqK2k
Name 1-(Hex-5-enyl)-4-isopropyl-5-methoxy-1,2-dihydrobenzocyclobutene-1-carbonitrile
Alternate Name(s) 7-(5-hexenyl)-3-isopropyl-4-methoxybicyclo[4.2.0]octa-1,3,5-triene-7-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H25NO
InChI InChI=1S/C19H25NO/c1-5-6-7-8-9-19(13-20)12-15-10-16(14(2)3)18(21-4)11-17(15)19/h5,10-11,14H,1,6-9,12H2,2-4H3
InChIKey GMJTWQROQSUOKF-UHFFFAOYSA-N
Molecular Weight 283.415 g/mol
SMILES c12c(cc(c(c2)C(C)C)OC)C(C1)(C#N)CCCCC=C
SPLASH splash10-05mo-9040000000-4209426564478e3802a9
Source of Spectrum KC-0-3534-4
Wiley ID 823891