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Methyl 2-[2-(methylthio)ethyl]pyrrolo[2,3-e]benzoxazole-5-carboxylate
SpectraBase Compound ID 92DbQOiAeNt
InChI InChI=1S/C14H14N2O3S/c1-18-14(17)9-7-10-13(12-8(9)3-5-15-12)16-11(19-10)4-6-20-2/h3,5,7,15H,4,6H2,1-2H3
InChIKey BREUGMWLCRCHGN-UHFFFAOYSA-N
Mol Weight 290.34 g/mol
Molecular Formula C14H14N2O3S
Exact Mass 290.072513 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DEucv0UwlYc
Name Methyl 2-[2-(methylthio)ethyl]pyrrolo[2,3-e]benzoxazole-5-carboxylate
CAS Registry Number 116350-42-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14N2O3S
InChI InChI=1S/C14H14N2O3S/c1-18-14(17)9-7-10-13(12-8(9)3-5-15-12)16-11(19-10)4-6-20-2/h3,5,7,15H,4,6H2,1-2H3
InChIKey BREUGMWLCRCHGN-UHFFFAOYSA-N
Molecular Weight 290.337 g/mol
SMILES [nH]1ccc2c(cc3oc(nc3c12)CCSC)C(=O)OC
SPLASH splash10-03dl-6590000000-94fcaa177016cbf65ed0
Source of Spectrum J-53-5165-6
Synonyms Methyl 2-[2-(methylsulfanyl)ethyl]-8H-[1,3]oxazolo[5,4-g]indole-5-carboxylate
Wiley ID 1293293