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-(5-methyl-1,3,4-oxadiazol-2-yl)pent-1-en-1-yl]-N,2-dimethoxy-3-methylbenzenecarboximidoyl Fluoride
SpectraBase Compound ID 57OAFchyqyQ
InChI InChI=1S/C27H29FN4O5/c1-15-11-18(13-21(24(15)34-5)26(28)31-35-6)20(9-7-8-10-23-30-29-17(3)36-23)19-12-16(2)25-22(14-19)32(4)27(33)37-25/h9,11-14H,7-8,10H2,1-6H3/b20-9+,31-26?
InChIKey AUZXRNXPKRJTJZ-QLFVRAPFSA-N
Mol Weight 508.55 g/mol
Molecular Formula C27H29FN4O5
Exact Mass 508.212198 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 84eVZjcEimr
Name 5-[(1E)-1-(3,7-Dimethyl-2-oxo-2,3-dihydro-1,3-benzoxazol-5-yl)-5-(5-methyl-1,3,4-oxadiazol-2-yl)pent-1-en-1-yl]-N,2-dimethoxy-3-methylbenzenecarboximidoyl Fluoride
Appearance Oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H29FN4O5
InChI InChI=1S/C27H29FN4O5/c1-15-11-18(13-21(24(15)34-5)26(28)31-35-6)20(9-7-8-10-23-30-29-17(3)36-23)19-12-16(2)25-22(14-19)32(4)27(33)37-25/h9,11-14H,7-8,10H2,1-6H3/b20-9+,31-26?
InChIKey AUZXRNXPKRJTJZ-QLFVRAPFSA-N
Ionization Type EI
Molecular Weight 508.550 g/mol
Reported Formula C27H29FN4O5
SMILES c1c(c(c(cc1\C(=C/CCCc1nnc(o1)C)c1cc2c(c(c1)C)OC(N2C)=O)C)OC)C(F)=NOC
SPLASH splash10-0a4j-7203900000-ee872f27ebdd0feb42d5
Source of Spectrum US20170267667A1
Wiley ID 1866095