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

*Links on SpectraBase are not permalinks.
Ethyl (E,1RS,2SR,6RS,7RS)-(11-benzyl-3,5-dioxo-4-phenyl-4,11-diaza-tricyclo[5.3.1.0(2,6)]undec-8-ylidene)-acetate
SpectraBase Compound ID A46si7CghKq
InChI InChI=1S/C26H26N2O4/c1-2-32-21(29)15-18-13-14-20-22-23(24(18)27(20)16-17-9-5-3-6-10-17)26(31)28(25(22)30)19-11-7-4-8-12-19/h3-12,15,20,22-24H,2,13-14,16H2,1H3/b18-15+/t20-,22-,23+,24+/m0/s1
InChIKey QRDLUCGUCRPRTA-VULJIKIJSA-N
Mol Weight 430.5 g/mol
Molecular Formula C26H26N2O4
Exact Mass 430.189257 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 3b5PgVlWIi
Name Ethyl (E,1RS,2SR,6RS,7RS)-(11-benzyl-3,5-dioxo-4-phenyl-4,11-diaza-tricyclo[5.3.1.0(2,6)]undec-8-ylidene)-acetate
Alternate Name(s) Ethyl (E,1RS,2SR,6RS,7RS)-(11-benzyl-3,5-dioxo-4-phenyl-4,11-diazatricyclo[5.3.1.0(2,6)]undec-8-ylidene)-acetate (E)-ethyl 2-((3aS,4S,8S,8aR)-9-benzyl-1,3-dioxo-2-phenyloctahydro-4,8-epiminocyclohepta[c]pyrrol-5(1H)-ylidene)acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H26N2O4
InChI InChI=1S/C26H26N2O4/c1-2-32-21(29)15-18-13-14-20-22-23(24(18)27(20)16-17-9-5-3-6-10-17)26(31)28(25(22)30)19-11-7-4-8-12-19/h3-12,15,20,22-24H,2,13-14,16H2,1H3/b18-15+/t20-,22-,23+,24+/m0/s1
InChIKey QRDLUCGUCRPRTA-VULJIKIJSA-N
Molecular Weight 430.504 g/mol
SMILES [C@]12([C@@](C(=O)N(C2=O)c2ccccc2)([C@@]2(CC\C([C@]1(N2Cc1ccccc1)[H])=C/C(=O)OCC)[H])[H])[H]
SPLASH splash10-053u-4071900000-274ccb6eef128160f90b
Source of Spectrum F5-6-3191-E-17a
Wiley ID 1733613