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

*Links on SpectraBase are not permalinks.
2-Propyn-1-one, 3-(2-hydroxyphenyl)-1-(3,4,5-trimethoxyphenyl)-
SpectraBase Compound ID 2u1ypDpeopz
InChI InChI=1S/C18H16O5/c1-21-16-10-13(11-17(22-2)18(16)23-3)15(20)9-8-12-6-4-5-7-14(12)19/h4-7,10-11,19H,1-3H3
InChIKey RPMGZIUZTPRYAE-UHFFFAOYSA-N
Mol Weight 312.32 g/mol
Molecular Formula C18H16O5
Exact Mass 312.099774 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 3BN9SuC50Jk
Name 2-Propyn-1-one, 3-(2-hydroxyphenyl)-1-(3,4,5-trimethoxyphenyl)-
CAS Registry Number 125130-99-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H16O5
InChI InChI=1S/C18H16O5/c1-21-16-10-13(11-17(22-2)18(16)23-3)15(20)9-8-12-6-4-5-7-14(12)19/h4-7,10-11,19H,1-3H3
InChIKey RPMGZIUZTPRYAE-UHFFFAOYSA-N
Molecular Weight 312.321 g/mol
SMILES Oc1c(C#CC(c2cc(OC)c(c(c2)OC)OC)=O)cccc1
SPLASH splash10-03di-0339000000-a582a4df26e4db368b52
Source of Spectrum H-72-455-37
Synonyms 3-(2-hydroxyphenyl)-1-(3,4,5-trimethoxyphenyl)-2-propyn-1-one 3-(2-Hydroxyphenyl)-3',4',5'-trimethoxyprop-2-ynophenone
Wiley ID 1313331