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4-(1,2-Dithiocyanatoethyl)phenyl acetate

View entire compound with spectra: 1 MS (GC)

4-(1,2-Dithiocyanatoethyl)phenyl acetate
SpectraBase Compound ID IEq3VOh2g0U
InChI InChI=1S/C12H10N2O2S2/c1-9(15)16-11-4-2-10(3-5-11)12(18-8-14)6-17-7-13/h2-5,12H,6H2,1H3
InChIKey YGBFORMDQSAUSR-UHFFFAOYSA-N
Mol Weight 278.34 g/mol
Molecular Formula C12H10N2O2S2
Exact Mass 278.01837 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FBNidL6yoGj
Name 4-(1,2-Dithiocyanatoethyl)phenyl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10N2O2S2
InChI InChI=1S/C12H10N2O2S2/c1-9(15)16-11-4-2-10(3-5-11)12(18-8-14)6-17-7-13/h2-5,12H,6H2,1H3
InChIKey YGBFORMDQSAUSR-UHFFFAOYSA-N
Molecular Weight 278.344 g/mol
SMILES C(C)(=O)Oc1ccc(cc1)C(CSC#N)SC#N
SPLASH splash10-0aec-6920000000-3553f3ce5f14c1099566
Source of Spectrum C5-2004-1985-3
Synonyms 4-[1,2-bis(cyanosulfanyl)ethyl]phenyl acetate Acetic acid[4-(1,2-dithiocyanatoethyl)phenyl]ester [4-(1,2-Dithiocyanatoethyl)phenyl]ethanoate [4-(1,2-dithiocyanatoethyl)phenyl] acetate [4-(1,2-dithiocyanatoethyl)phenyl] ethanoate
Wiley ID 1617120