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

*Links on SpectraBase are not permalinks.
3-Octyne-2,5-dione, 6,6,7-trimethyl-
SpectraBase Compound ID 1TGE2S1A0BG
InChI InChI=1S/C11H16O2/c1-8(2)11(4,5)10(13)7-6-9(3)12/h8H,1-5H3
InChIKey UJBNAMSJNYDAJG-UHFFFAOYSA-N
Mol Weight 180.25 g/mol
Molecular Formula C11H16O2
Exact Mass 180.11503 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 2WIcfQxT1c
Name 3-Octyne-2,5-dione, 6,6,7-trimethyl-
Alternate Name(s) 6,6,7-Trimethyl-3-octyne-2,5-dione 6,6,7-trimethyloct-3-yne-2,5-dione
CAS Registry Number 63922-61-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16O2
InChI InChI=1S/C11H16O2/c1-8(2)11(4,5)10(13)7-6-9(3)12/h8H,1-5H3
InChIKey UJBNAMSJNYDAJG-UHFFFAOYSA-N
Molecular Weight 180.247 g/mol
SMILES C(C(C(C)C)(C)C)(C#CC(C)=O)=O
SPLASH splash10-000g-9000000000-aa0af32300c53353bd6d
Source of Spectrum H-60-766-0
Wiley ID 1176436