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4-(1-Azido3-methylbut-2-en-2-yl)benzenoic acid methyl ester
SpectraBase Compound ID 8OHsPm4xd9M
InChI InChI=1S/C13H15N3O2/c1-9(2)12(8-15-16-14)10-4-6-11(7-5-10)13(17)18-3/h4-7H,8H2,1-3H3
InChIKey WVYUQKDNWMDOHC-UHFFFAOYSA-N
Mol Weight 245.28 g/mol
Molecular Formula C13H15N3O2
Exact Mass 245.116427 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5jxUjYPTumJ
Name 4-(1-Azido3-methylbut-2-en-2-yl)benzenoic acid methyl ester
Alternate Name(s) Methyl 4-[1-(azidomethyl)-2-methyl-1-propenyl]benzoate
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Formula C13H15N3O2
InChI InChI=1S/C13H15N3O2/c1-9(2)12(8-15-16-14)10-4-6-11(7-5-10)13(17)18-3/h4-7H,8H2,1-3H3
InChIKey WVYUQKDNWMDOHC-UHFFFAOYSA-N
Molecular Weight 245.282 g/mol
SMILES C(N=[N+]=[N-])C(=C(C)C)c1ccc(C(=O)OC)cc1
SPLASH splash10-0pvl-1950000000-4bbfc7f77a2f2f119c3c
Source of Spectrum KC-57-7734-17
Wiley ID 1625620