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Tebuconazole
SpectraBase Compound ID Cox3idFsqzY
InChI InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3
InChIKey PXMNMQRDXWABCY-UHFFFAOYSA-N
Mol Weight 307.82 g/mol
Molecular Formula C16H22ClN3O
Exact Mass 307.14514 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HZ4LRjeGP3t
Name Tebuconazol
Carrier Gas Helium (20 psi)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 307.145140039 u
Formula C16H22ClN3O
GC Column HP-5MS (30 m x 0.25 mm, film thickness 0.25 micrometer)
GC Oven Program Oven temp 280oC
InChI InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3
InChIKey PXMNMQRDXWABCY-UHFFFAOYSA-N
Instrument Name Agilent 6890-5973N
Ionization Type EI
Literature Reference DOI 10.1002/jssc.200500250
Quality 40
SMILES OC(C(C)(C)C)(CCC1=CC=C(C=C1)Cl)CN1C=NC=N1
SPLASH splash10-0fi0-4980000000-03db8de4fc6ed3f6bf66
Source of Spectrum SEP-29-2335-Tebuconazol (DOI: 10.1002/jssc.200500250)
Wiley ID 1906182