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Isoxazole, 3,4-dimethyl-5-(2-thienyl)-
SpectraBase Compound ID 7SNq8vFsERT
InChI InChI=1S/C9H9NOS/c1-6-7(2)10-11-9(6)8-4-3-5-12-8/h3-5H,1-2H3
InChIKey LGUFOHIGWDGSRM-UHFFFAOYSA-N
Mol Weight 179.24 g/mol
Molecular Formula C9H9NOS
Exact Mass 179.040485 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Y8nN7w11gJ
Name Isoxazole, 3,4-dimethyl-5-(2-thienyl)-
Alternate Name(s) 3,4-Dimethyl-5-(2-thienyl)isoxazole 3,4-Dimethyl-5-thiophen-2-yl-1,2-oxazole 3,4-Dimethyl-5-thiophen-2-ylisoxazole
CAS Registry Number 56421-65-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9NOS
InChI InChI=1S/C9H9NOS/c1-6-7(2)10-11-9(6)8-4-3-5-12-8/h3-5H,1-2H3
InChIKey LGUFOHIGWDGSRM-UHFFFAOYSA-N
Molecular Weight 179.237 g/mol
SMILES Cc1c(C)noc1-c1cccs1
SPLASH splash10-01t9-4900000000-c353674563c00479f17a
Source of Spectrum J-40-3186-6
Wiley ID 1175063