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

*Links on SpectraBase are not permalinks.

5-[(1E)-1-(3,7-Dimethyl-2-oxo-2,3-dihydro-1,3-benzoxazol-5-yl)-5-(2-oxo-1,3-oxazolidin-3-yl)pent-1-en-1-yl]-N,2-dimethoxy-3-methylbenzenecarboximidoyl Chloride

View entire compound with spectra: 1 MS (GC)

5-[(1E)-1-(3,7-Dimethyl-2-oxo-2,3-dihydro-1,3-benzoxazol-5-yl)-5-(2-oxo-1,3-oxazolidin-3-yl)pent-1-en-1-yl]-N,2-dimethoxy-3-methylbenzenecarboximidoyl Chloride
SpectraBase Compound ID GyJR95Ytb24
InChI InChI=1S/C27H30ClN3O6/c1-16-12-18(14-21(23(16)34-4)25(28)29-35-5)20(8-6-7-9-31-10-11-36-27(31)33)19-13-17(2)24-22(15-19)30(3)26(32)37-24/h8,12-15H,6-7,9-11H2,1-5H3/b20-8+,29-25?
InChIKey YHWUVPWANZMYHE-OJLZICFASA-N
Mol Weight 528.01 g/mol
Molecular Formula C27H30ClN3O6
Exact Mass 527.182313 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 2JUlytOz4WJ
Name 5-[(1E)-1-(3,7-Dimethyl-2-oxo-2,3-dihydro-1,3-benzoxazol-5-yl)-5-(2-oxo-1,3-oxazolidin-3-yl)pent-1-en-1-yl]-N,2-dimethoxy-3-methylbenzenecarboximidoyl Chloride
Appearance Clear oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H30ClN3O6
InChI InChI=1S/C27H30ClN3O6/c1-16-12-18(14-21(23(16)34-4)25(28)29-35-5)20(8-6-7-9-31-10-11-36-27(31)33)19-13-17(2)24-22(15-19)30(3)26(32)37-24/h8,12-15H,6-7,9-11H2,1-5H3/b20-8+,29-25?
InChIKey YHWUVPWANZMYHE-OJLZICFASA-N
Ionization Type EI
Molecular Weight 528.005 g/mol
Reported Formula C27H30(35)ClN3O6
SMILES c1c(c(c(cc1\C(=C/CCCN1CCOC1=O)c1cc2c(c(c1)C)OC(N2C)=O)C)OC)C(Cl)=NOC
SPLASH splash10-006t-0109000000-5cb05bbf8fd76ef7a013
Source of Spectrum US20170267667A1
Wiley ID 1866073