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5-[1-[(N-tert-Butoxycarbonyl)azo]ethylene]-2-phenylthiazolin-4-one
SpectraBase Compound ID 2RB1o15nO0X
InChI InChI=1S/C16H19N3O3S/c1-10(18-19-15(21)22-16(2,3)4)12-13(20)17-14(23-12)11-8-6-5-7-9-11/h5-9,12H,1-4H3,(H,19,21)/b18-10+
InChIKey CMWIBXQOLLLHNR-VCHYOVAHSA-N
Mol Weight 333.41 g/mol
Molecular Formula C16H19N3O3S
Exact Mass 333.114713 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KIXMlZBHOf8
Name 5-[1-[(N-tert-Butoxycarbonyl)azo]ethylene]-2-phenylthiazolin-4-one
Comments Less than 3 mono-isotopic peaks
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Formula C16H19N3O3S
InChI InChI=1S/C16H19N3O3S/c1-10(18-19-15(21)22-16(2,3)4)12-13(20)17-14(23-12)11-8-6-5-7-9-11/h5-9,12H,1-4H3,(H,19,21)/b18-10+
InChIKey CMWIBXQOLLLHNR-VCHYOVAHSA-N
Molecular Weight 333.406 g/mol
SMILES N(C(OC(C)(C)C)=O)\N=C\(C1C(N=C(S1)c1ccccc1)=O)C
SPLASH splash10-004i-0092000000-f1d2cf92c1755bbe7931
Source of Spectrum KC-57-5862-18
Wiley ID 1624962