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

*Links on SpectraBase are not permalinks.
1-Benzyl-7-chloro-7-cyano-5-tert-butoxycarbonylhexahydro-1H-pyrrolo[1,2-a]imidazole
SpectraBase Compound ID AEkSheVDEQ7
InChI InChI=1S/C19H24ClN3O2/c1-18(2,3)25-16(24)15-11-19(20,13-21)17-22(9-10-23(15)17)12-14-7-5-4-6-8-14/h4-8,15,17H,9-12H2,1-3H3
InChIKey SENGORNJGNLGKB-UHFFFAOYSA-N
Mol Weight 361.87 g/mol
Molecular Formula C19H24ClN3O2
Exact Mass 361.155705 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 5Y8aBigVyXS
Name 1-Benzyl-7-chloro-7-cyano-5-tert-butoxycarbonylhexahydro-1H-pyrrolo[1,2-a]imidazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H24ClN3O2
InChI InChI=1S/C19H24ClN3O2/c1-18(2,3)25-16(24)15-11-19(20,13-21)17-22(9-10-23(15)17)12-14-7-5-4-6-8-14/h4-8,15,17H,9-12H2,1-3H3
InChIKey SENGORNJGNLGKB-UHFFFAOYSA-N
Molecular Weight 361.873 g/mol
SMILES C12N(C(CC2(C#N)Cl)C(OC(C)(C)C)=O)CCN1Cc1ccccc1
SPLASH splash10-002f-9760000000-5e9e843c38e0b7c0e98b
Source of Spectrum KC-1-2068-19
Synonyms tert-Butyl 1-benzyl-7-chloro-7-cyanohexahydro-1H-pyrrolo[1,2-a]imidazole-5-carboxylate
Wiley ID 825808