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

*Links on SpectraBase are not permalinks.
Benzeneacetamide, N-[1-(2-bromophenyl)-2-oxo-4-(2-phenylethenyl)-3-azetidinyl]-, [3.alpha.,4.alpha.(E)]-
SpectraBase Compound ID 4kvC2ztd5dh
InChI InChI=1S/C25H21BrN2O2/c26-20-13-7-8-14-21(20)28-22(16-15-18-9-3-1-4-10-18)24(25(28)30)27-23(29)17-19-11-5-2-6-12-19/h1-16,22,24H,17H2,(H,27,29)/b16-15+/t22-,24+/m0/s1
InChIKey CNEWIQYEVXCGTB-QKCRJPCFSA-N
Mol Weight 461.36 g/mol
Molecular Formula C25H21BrN2O2
Exact Mass 460.078641 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 6t4sNOVS9ye
Name Benzeneacetamide, N-[1-(2-bromophenyl)-2-oxo-4-(2-phenylethenyl)-3-azetidinyl]-, [3.alpha.,4.alpha.(E)]-
CAS Registry Number 111708-43-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H21BrN2O2
InChI InChI=1S/C25H21BrN2O2/c26-20-13-7-8-14-21(20)28-22(16-15-18-9-3-1-4-10-18)24(25(28)30)27-23(29)17-19-11-5-2-6-12-19/h1-16,22,24H,17H2,(H,27,29)/b16-15+/t22-,24+/m0/s1
InChIKey CNEWIQYEVXCGTB-QKCRJPCFSA-N
Molecular Weight 461.359 g/mol
SMILES N([C@@]1([C@@](N(C1=O)c1c(Br)cccc1)(\C=C\c1ccccc1)[H])[H])C(=O)Cc1ccccc1
SPLASH splash10-006w-4930000000-f0051835f2a66db6653c
Source of Spectrum I-65-106-4
Synonyms N-(2'-bromo-phenyl)-3-(benzylcarboxyamino)-4-(2-phenyl-ethenyl)-1-aza-cyclobutan-2-one N-{(3R,4S)-1-(2-bromophenyl)-2-oxo-4-[(E)-2-phenylethenyl]azetidinyl}-2-phenylacetamide
Wiley ID 1390471