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1-Benzo[1,3]dioxol-5-yl-5-cyclopropylmethylsulfanyl-1H-tetrazole
SpectraBase Compound ID E8lUSDzI7WW
InChI InChI=1S/C12H12N4O2S/c1-2-8(1)6-19-12-13-14-15-16(12)9-3-4-10-11(5-9)18-7-17-10/h3-5,8H,1-2,6-7H2
InChIKey CCORFMLPTVXOEI-UHFFFAOYSA-N
Mol Weight 276.31 g/mol
Molecular Formula C12H12N4O2S
Exact Mass 276.068097 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IEVWXiHiz7
Name 1-Benzo[1,3]dioxol-5-yl-5-cyclopropylmethylsulfanyl-1H-tetrazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12N4O2S
InChI InChI=1S/C12H12N4O2S/c1-2-8(1)6-19-12-13-14-15-16(12)9-3-4-10-11(5-9)18-7-17-10/h3-5,8H,1-2,6-7H2
InChIKey CCORFMLPTVXOEI-UHFFFAOYSA-N
Molecular Weight 276.314 g/mol
SMILES C(C1CC1)Sc1[n](nnn1)-c1cc2OCOc2cc1
SPLASH splash10-03di-7900000000-d6c76dd4eafd1e5031ff
Synonyms 1-(1,3-Benzodioxol-5-yl)-1H-tetraazol-5-yl cyclopropylmethyl sulfide 1-(1,3-benzodioxol-5-yl)-5-(cyclopropylmethylsulfanyl)-1,2,3,4-tetrazole 1-(1,3-benzodioxol-5-yl)-5-(cyclopropylmethylsulfanyl)tetrazole 1-(1,3-benzodioxol-5-yl)-5-(cyclopropylmethylthio)tetrazole
Wiley ID 1463385