For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
5-Methyl-4-(4-bromophenyl)-2-[2-(3-methyl-2,3-dihydrobenzofuran-3-ylmethyl)allyl]-1,3,3a.alpha.,4.beta.,6.alpha..beta.,6a.alpha.-hexahydropyrrolo[3,4-c]pyrrole-1,3-dione
SpectraBase Compound ID JdORmRtczin
InChI InChI=1S/C26H27BrN2O3/c1-16(12-26(2)15-32-21-7-5-4-6-20(21)26)13-29-24(30)19-14-28(3)23(22(19)25(29)31)17-8-10-18(27)11-9-17/h4-11,19,22-23H,1,12-15H2,2-3H3/t19?,22?,23-,26?/m1/s1
InChIKey XTEWHWQCAILAGQ-XBFCOIOGSA-N
Mol Weight 495.42 g/mol
Molecular Formula C26H27BrN2O3
Exact Mass 494.120506 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID KDm0zmX7w0j
Name 5-Methyl-4-(4-bromophenyl)-2-[2-(3-methyl-2,3-dihydrobenzofuran-3-ylmethyl)allyl]-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 C26H27BrN2O3
InChI InChI=1S/C26H27BrN2O3/c1-16(12-26(2)15-32-21-7-5-4-6-20(21)26)13-29-24(30)19-14-28(3)23(22(19)25(29)31)17-8-10-18(27)11-9-17/h4-11,19,22-23H,1,12-15H2,2-3H3/t19?,22?,23-,26?/m1/s1
InChIKey XTEWHWQCAILAGQ-XBFCOIOGSA-N
Molecular Weight 495.417 g/mol
SMILES C1(N(C(C2CN([C@@](C12)(c1ccc(cc1)Br)[H])C)=O)CC(CC1(c2c(cccc2)OC1)C)=C)=O
SPLASH splash10-053r-0901000000-fd4761c6c54d702bd965
Source of Spectrum KC-57-7988-23
Wiley ID 1625797