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3-Undecanyl-5-methyl-benzo(d)isoxazole

View entire compound with spectra: 1 MS (GC)

3-Undecanyl-5-methyl-benzo(d)isoxazole
SpectraBase Compound ID FVQ6YHhNXqT
InChI InChI=1S/C19H29NO/c1-3-4-5-6-7-8-9-10-11-12-18-17-15-16(2)13-14-19(17)21-20-18/h13-15H,3-12H2,1-2H3
InChIKey UNAFBPOYCGTUND-UHFFFAOYSA-N
Mol Weight 287.45 g/mol
Molecular Formula C19H29NO
Exact Mass 287.224915 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CAD3COki9pY
Name 3-Undecanyl-5-methyl-benzo(d)isoxazole
CAS Registry Number 131222-29-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H29NO
InChI InChI=1S/C19H29NO/c1-3-4-5-6-7-8-9-10-11-12-18-17-15-16(2)13-14-19(17)21-20-18/h13-15H,3-12H2,1-2H3
InChIKey UNAFBPOYCGTUND-UHFFFAOYSA-N
Molecular Weight 287.447 g/mol
SMILES c12onc(c1cc(cc2)C)CCCCCCCCCCC
SPLASH splash10-01p2-3910000000-9ddb582a02630c90e0c1
Source of Spectrum O-21-38-12
Synonyms 5-Methyl-3-undecyl-1,2-benzisoxazole 5-Methyl-3-undecyl-1,2-benzoxazole 5-Methyl-3-undecyl-indoxazene
Wiley ID 1291044