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1-Isopropyl-5-(benzoyl)methyltetrazole
SpectraBase Compound ID IhW26ZmyAKc
InChI InChI=1S/C12H14N4O/c1-9(2)16-12(13-14-15-16)8-11(17)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3
InChIKey BSIZXAZLNALBRJ-UHFFFAOYSA-N
Mol Weight 230.27 g/mol
Molecular Formula C12H14N4O
Exact Mass 230.116761 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HlFFvoLRoEl
Name 1-Isopropyl-5-(benzoyl)methyltetrazole
Alternate Name(s) 2-(1-isopropyl-1H-tetraazol-5-yl)-1-phenylethanone
Comments Less than 3 mono-isotopic peaks
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Formula C12H14N4O
InChI InChI=1S/C12H14N4O/c1-9(2)16-12(13-14-15-16)8-11(17)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3
InChIKey BSIZXAZLNALBRJ-UHFFFAOYSA-N
Molecular Weight 230.271 g/mol
SMILES c1(nnn[n]1C(C)C)CC(c1ccccc1)=O
SPLASH splash10-0udi-0090000000-be055655544650e07513
Source of Spectrum SO-0-454-7
Wiley ID 1540012