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1-(Benzothiazol-2-ylsulfanyl)dodecan-2-ol
SpectraBase Compound ID 2sof9wLrHYX
InChI InChI=1S/C19H29NOS2/c1-2-3-4-5-6-7-8-9-12-16(21)15-22-19-20-17-13-10-11-14-18(17)23-19/h10-11,13-14,16,21H,2-9,12,15H2,1H3
InChIKey JESFEHVRCYZBKP-UHFFFAOYSA-N
Mol Weight 351.57 g/mol
Molecular Formula C19H29NOS2
Exact Mass 351.169057 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 60PO2p0zKgG
Name 1-(Benzothiazol-2-ylsulfanyl)dodecan-2-ol
Alternate Name(s) 1-(1,3-benzothiazol-2-ylsulfanyl)-2-dodecanol 1-(1,3-benzothiazol-2-ylthio)-2-dodecanol 1-(1,3-benzothiazol-2-ylsulfanyl)dodecan-2-ol
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Formula C19H29NOS2
InChI InChI=1S/C19H29NOS2/c1-2-3-4-5-6-7-8-9-12-16(21)15-22-19-20-17-13-10-11-14-18(17)23-19/h10-11,13-14,16,21H,2-9,12,15H2,1H3
InChIKey JESFEHVRCYZBKP-UHFFFAOYSA-N
Molecular Weight 351.567 g/mol
SMILES OC(CSc1nc2ccccc2s1)CCCCCCCCCC
SPLASH splash10-014i-2910000000-ddc2cf8d9958e6437446
Source of Spectrum QC-10-1923-3
Wiley ID 871322