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

View entire compound with spectra: 1 MS (GC)

endo-5-Methyl-4-(3-bromophenyl)-2-prop-2-ynyl-1,3,3a.alpha.,4.beta.,6.alpha..beta.,6a.beta.-hexahydropyrrolo[3,4-c]pyrrole-1,3-dione
SpectraBase Compound ID 5f8LEnEilEf
InChI InChI=1S/C16H15BrN2O2/c1-3-7-19-15(20)12-9-18(2)14(13(12)16(19)21)10-5-4-6-11(17)8-10/h1,4-6,8,12-14H,7,9H2,2H3/t12-,13+,14-/m1/s1
InChIKey CEDBJQCLJCQVJF-HZSPNIEDSA-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 LExDoqujPDZ
Name endo-5-Methyl-4-(3-bromophenyl)-2-prop-2-ynyl-1,3,3a.alpha.,4.beta.,6.alpha..beta.,6a.beta.-hexahydropyrrolo[3,4-c]pyrrole-1,3-dione
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H15BrN2O2
InChI InChI=1S/C16H15BrN2O2/c1-3-7-19-15(20)12-9-18(2)14(13(12)16(19)21)10-5-4-6-11(17)8-10/h1,4-6,8,12-14H,7,9H2,2H3/t12-,13+,14-/m1/s1
InChIKey CEDBJQCLJCQVJF-HZSPNIEDSA-N
Molecular Weight 347.212 g/mol
SMILES [C@@]12([C@](C(=O)N(C2=O)CC#C)(CN([C@@]1(c1cc(Br)ccc1)[H])C)[H])[H]
SPLASH splash10-01oy-8898000000-68d6b89e48086dbecbe7
Source of Spectrum KC-57-7985-21
Wiley ID 1625816