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(3aR,4S,6aS)-4-(azidomethyl)-2,2-dimethyl-5-(phenylmethyl)-3a,4,6,6a-tetrahydro-[1,3]dioxolo[4,5-c]pyrrole
SpectraBase Compound ID J4vGvVd4Ul4
InChI InChI=1S/C15H20N4O2/c1-15(2)20-13-10-19(9-11-6-4-3-5-7-11)12(8-17-18-16)14(13)21-15/h3-7,12-14H,8-10H2,1-2H3/t12-,13-,14+/m0/s1
InChIKey MFRNPUMJKNBWKE-MELADBBJSA-N
Mol Weight 288.35 g/mol
Molecular Formula C15H20N4O2
Exact Mass 288.158626 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1kWzNk5WN2R
Name (3aR,4S,6aS)-4-(azidomethyl)-2,2-dimethyl-5-(phenylmethyl)-3a,4,6,6a-tetrahydro-[1,3]dioxolo[4,5-c]pyrrole
Comments Less than 3 mono-isotopic peaks
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Formula C15H20N4O2
InChI InChI=1S/C15H20N4O2/c1-15(2)20-13-10-19(9-11-6-4-3-5-7-11)12(8-17-18-16)14(13)21-15/h3-7,12-14H,8-10H2,1-2H3/t12-,13-,14+/m0/s1
InChIKey MFRNPUMJKNBWKE-MELADBBJSA-N
Molecular Weight 288.351 g/mol
SMILES [C@@]1(N(C[C@@]2(OC(O[C@]12[H])(C)C)[H])Cc1ccccc1)(CN=[N+]=[N-])[H]
SPLASH splash10-0006-9000000000-7705024733bdb8384957
Source of Spectrum KC-0-805-16
Synonyms (3aR,4S,6aS)-4-(azidomethyl)-5-benzyl-2,2-dimethyl-3a,4,6,6a-tetrahydro-[1,3]dioxolo[4,5-c]pyrrole
Wiley ID 785242