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endo-4-(4-Bromophenyl)-5-methyl-2-prop-2-ynyl-1,3,3a.alpha.,4.beta.,6.alpha.,.beta.,6a.alpha.-hexahydropyrrolo[3,4-c]pyrrole-1,3-dione

View entire compound with spectra: 2 MS (GC)

endo-4-(4-Bromophenyl)-5-methyl-2-prop-2-ynyl-1,3,3a.alpha.,4.beta.,6.alpha.,.beta.,6a.alpha.-hexahydropyrrolo[3,4-c]pyrrole-1,3-dione
SpectraBase Compound ID DvTj4cTi4QQ
InChI InChI=1S/C16H15BrN2O2/c1-3-8-19-15(20)12-9-18(2)14(13(12)16(19)21)10-4-6-11(17)7-5-10/h1,4-7,12-14H,8-9H2,2H3/t12-,13-,14+/m0/s1
InChIKey QNHGGLSLKDYMBS-MELADBBJSA-N
Mol Weight 347.21 g/mol
Molecular Formula C16H15BrN2O2
Exact Mass 346.031691 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5yqCn7GZCHY
Name endo-4-(4-Bromophenyl)-5-methyl-2-prop-2-ynyl-1,3,3a.alpha.,4.beta.,6.alpha.,.beta.,6a.alpha.-hexahydropyrrolo[3,4-c]pyrrole-1,3-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H15BrN2O2
InChI InChI=1S/C16H15BrN2O2/c1-3-8-19-15(20)12-9-18(2)14(13(12)16(19)21)10-4-6-11(17)7-5-10/h1,4-7,12-14H,8-9H2,2H3/t12-,13-,14+/m0/s1
InChIKey QNHGGLSLKDYMBS-MELADBBJSA-N
Molecular Weight 347.212 g/mol
SMILES [C@@]12([C@@](C(=O)N(C2=O)CC#C)(CN([C@@]1(c1ccc(cc1)Br)[H])C)[H])[H]
SPLASH splash10-01oy-8369000000-464b8bf4df17b85cc904
Source of Spectrum KC-57-7985-21
Synonyms endo-5-Methyl-4-(4-bromophenyl)-2-prop-2-ynyl-1,3,3a.alpha.,4.beta.,6.alpha..beta.,6a.alpha.-hexahydropyrrolo[3,4-c]pyrrole-1,3-dione
Wiley ID 1625887