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Chloroatranol
SpectraBase Compound ID 6QSZccoLxSV
InChI InChI=1S/C8H7ClO3/c1-4-2-6(11)5(3-10)8(12)7(4)9/h2-3,11-12H,1H3
InChIKey IOTAGSGSURFFDS-UHFFFAOYSA-N
Mol Weight 186.59 g/mol
Molecular Formula C8H7ClO3
Exact Mass 186.008372 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IO7arrxUd7E
Name Chloroatranol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H7ClO3
InChI InChI=1S/C8H7ClO3/c1-4-2-6(11)5(3-10)8(12)7(4)9/h2-3,11-12H,1H3
InChIKey IOTAGSGSURFFDS-UHFFFAOYSA-N
Instrument Name Agilent 7890A-5975C and Agilent-7693
Ionization Type EI
Literature Reference DOI 10.1002/ffj.3578
Molecular Weight 186.594 g/mol
SMILES Oc1c(c(c(c(c1)C)Cl)O)C=O
SPLASH splash10-000i-3900000000-10a53280a7afccafdd78
Source of Spectrum 10.1002/ffj.3578
Wiley ID 1856260