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Isothiocyanic acid, nonyl ester

View entire compound with spectra: 1 MS (GC)

Isothiocyanic acid, nonyl ester
SpectraBase Compound ID kecdpescJc
InChI InChI=1S/C10H19NS/c1-2-3-4-5-6-7-8-9-11-10-12/h2-9H2,1H3
InChIKey GSAYWRFRZHSPQB-UHFFFAOYSA-N
Mol Weight 185.33 g/mol
Molecular Formula C10H19NS
Exact Mass 185.123821 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3lZIR4Xsx6
Name Isothiocyanic acid, nonyl ester
Alternate Name(s) 1-Isothiocyanatononane N-nonyl isothiocyanate Nonyl isothiocyanate
CAS Registry Number 4430-43-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H19NS
InChI InChI=1S/C10H19NS/c1-2-3-4-5-6-7-8-9-11-10-12/h2-9H2,1H3
InChIKey GSAYWRFRZHSPQB-UHFFFAOYSA-N
Molecular Weight 185.329 g/mol
SMILES CCCCCCCCCN=C=S
SPLASH splash10-0006-9300000000-b0a70e0f849afe1d3c08
Source of Spectrum S-17-2145-9
Wiley ID 1181936