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6-Methyl-3-phenyl-2,1-benzisoxazole
SpectraBase Compound ID 3spCCSvJXVU
InChI InChI=1S/C14H11NO/c1-10-7-8-12-13(9-10)15-16-14(12)11-5-3-2-4-6-11/h2-9H,1H3
InChIKey UPDYILMEPGBEII-UHFFFAOYSA-N
Mol Weight 209.25 g/mol
Molecular Formula C14H11NO
Exact Mass 209.084064 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KWKYliBX4IT
Name 6-Methyl-3-phenyl-2,1-benzisoxazole
Alternate Name(s) 3-Phenyl-6-methyl-2,1-benzisoxazole 6-Methyl-3-phenyl-2,1-benzoxazole 6-Methyl-3-phenyl-anthranil
CAS Registry Number 80177-26-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H11NO
InChI InChI=1S/C14H11NO/c1-10-7-8-12-13(9-10)15-16-14(12)11-5-3-2-4-6-11/h2-9H,1H3
InChIKey UPDYILMEPGBEII-UHFFFAOYSA-N
Molecular Weight 209.248 g/mol
SMILES Cc1ccc2c(c1)noc2-c1ccccc1
SPLASH splash10-0a7i-5690000000-b2d03bf58113aea50753
Source of Spectrum O-24-72-0
Wiley ID 1208325