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1-Pentanethiol
SpectraBase Compound ID Ikl3V87DUtd
InChI InChI=1S/C5H12S/c1-2-3-4-5-6/h6H,2-5H2,1H3
InChIKey ZRKMQKLGEQPLNS-UHFFFAOYSA-N
Mol Weight 104.21 g/mol
Molecular Formula C5H12S
Exact Mass 104.065972 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6xSueXqbzGs
Name 1-Pentanethiol
Alternate Name(s) 1-Pentanthiol 1-Mercaptopentane Amyl hydrosulfide Amyl mercaptan Amyl mercaptans Amyl sulfhydrate Amyl thioalcohol CH3(CH2)4SH Mercaptan amilique Mercaptan amylique n-Amyl mercaptan n-Pentylmercaptan N-thioamyl alcohol Pentalarm Pentane-1-thiol Pentanethiol Pentyl mercaptan Thioamyl alcohol BRN 1730979 CASWELL NO. 642A EINECS 203-789-1 EPA PESTICIDE CHEMICAL CODE 100701 HSDB 468
CAS Registry Number 110-66-7
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Formula C5H12S
InChI InChI=1S/C5H12S/c1-2-3-4-5-6/h6H,2-5H2,1H3
InChIKey ZRKMQKLGEQPLNS-UHFFFAOYSA-N
Molecular Weight 104.211 g/mol
SMILES SCCCCC
SPLASH splash10-0006-9000000000-4bc5496c19d11c6e14b3
Source of Spectrum AA-0-297-4
Wiley ID 1121069