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(E)-(Thian-2-ylidene)acetonitrile S-oxide
SpectraBase Compound ID 83zZ9lUNKQ6
InChI InChI=1S/C7H9NOS/c8-5-4-7-3-1-2-6-10(7)9/h4H,1-3,6H2/b7-4+
InChIKey NYKRVYKXFHCXNC-QPJJXVBHSA-N
Mol Weight 155.21 g/mol
Molecular Formula C7H9NOS
Exact Mass 155.040485 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6BPs82L0mRE
Name (E)-(Thian-2-ylidene)acetonitrile S-oxide
Alternate Name(s) (2E)-(1-oxidotetrahydro-2H-thiopyran-2-ylidene)ethanenitrile
Comments Less than 3 mono-isotopic peaks
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Formula C7H9NOS
InChI InChI=1S/C7H9NOS/c8-5-4-7-3-1-2-6-10(7)9/h4H,1-3,6H2/b7-4+
InChIKey NYKRVYKXFHCXNC-QPJJXVBHSA-N
Molecular Weight 155.215 g/mol
SMILES C(\C=C\1S(CCCC1)=O)#N
SPLASH splash10-004i-9400000000-a6abd948e0a87d1eb527
Source of Spectrum O1-62-275-7
Wiley ID 1592425