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(trifluoromethylsulphanyl)methyl isocyanate
SpectraBase Compound ID BKXQ6Nb5RPE
InChI InChI=1S/C3H2F3NOS/c4-3(5,6)9-2-7-1-8/h2H2
InChIKey SMFVVRSQJASIAV-UHFFFAOYSA-N
Mol Weight 157.11 g/mol
Molecular Formula C3H2F3NOS
Exact Mass 156.980919 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2kTL4zuqfe4
Name (trifluoromethylsulphanyl)methyl isocyanate
CAS Registry Number 137947-08-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C3H2F3NOS
InChI InChI=1S/C3H2F3NOS/c4-3(5,6)9-2-7-1-8/h2H2
InChIKey SMFVVRSQJASIAV-UHFFFAOYSA-N
Molecular Weight 157.110 g/mol
SMILES C(SCN=C=O)(F)(F)F
SPLASH splash10-0a4i-9200000000-6eeab4ea717fe15a5974
Source of Spectrum K-125-578-8
Synonyms Trifluoro[(isocyanatomethyl)sulfanyl]methane
Wiley ID 1154450