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

*Links on SpectraBase are not permalinks.
4-[5'-(1'',3''-Benzodioxol-5''-yl)methyl]-2',2',3',4'-tetramethyl-6'-oxo-perhydropyrrolo[3,4-c]pyrrol-1'-yl}benzamidine
SpectraBase Compound ID EGHFmLAXQBK
InChI InChI=1S/C25H30N4O3/c1-14-21-20(24(30)29(14)12-15-5-10-18-19(11-15)32-13-31-18)22(28(4)25(21,2)3)16-6-8-17(9-7-16)23(26)27/h5-11,14,20-22H,12-13H2,1-4H3,(H3,26,27)/t14?,20?,21?,22-/m0/s1
InChIKey ZVHUDZOJVBUHDC-MQNBCSFCSA-N
Mol Weight 434.54 g/mol
Molecular Formula C25H30N4O3
Exact Mass 434.231791 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 6hS2nbTPzu
Name 4-[5'-(1'',3''-Benzodioxol-5''-yl)methyl]-2',2',3',4'-tetramethyl-6'-oxo-perhydropyrrolo[3,4-c]pyrrol-1'-yl}benzamidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H30N4O3
InChI InChI=1S/C25H30N4O3/c1-14-21-20(24(30)29(14)12-15-5-10-18-19(11-15)32-13-31-18)22(28(4)25(21,2)3)16-6-8-17(9-7-16)23(26)27/h5-11,14,20-22H,12-13H2,1-4H3,(H3,26,27)/t14?,20?,21?,22-/m0/s1
InChIKey ZVHUDZOJVBUHDC-MQNBCSFCSA-N
Molecular Weight 434.540 g/mol
SMILES N=C(c1ccc([C@@]2(N(C)C(C3C2C(N(Cc2cc4OCOc4cc2)C3C)=O)(C)C)[H])cc1)N
SPLASH splash10-001r-8910200000-9559970bb6d9382042cd
Source of Spectrum H-83-898-51
Wiley ID 847040