SpectraBase Spectrum ID |
B2ycycvX10q |
Name |
dichloroniobium; ethanol; (Z)-4-hydroxypent-3-en-2-one |
CAS Registry Number |
17035-43-7 |
Comments |
Note: The molecular formula of the structure shown is C9H20Cl2NbO4 - which differs from the formula reported for the mass spectrum (C9H17Cl2NbO4) |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C9H17Cl2NbO4 |
InChI |
InChI=1S/C5H8O2.2C2H6O.2ClH.Nb/c1-4(6)3-5(2)7;2*1-2-3;;;/h3,6H,1-2H3;2*3H,2H2,1H3;2*1H;/q;;;;;+2/p-2/b4-3-;;;;; |
InChIKey |
WAFIORZRROSJLI-GLUPTGNJSA-L |
Molecular Weight |
356.067 g/mol |
SMILES |
O\C(C)=C/C(C)=O.OCC.OCC.Cl[Nb]Cl |
SPLASH |
splash10-00kf-6297000000-d1a83abeef2b5d172a69 |
Source of Spectrum |
O7-0-1357-0 |
Synonyms |
dichloroniobium;ethanol;(Z)-4-hydroxy-3-penten-2-one
bis(chloranyl)niobium;ethanol;(Z)-4-oxidanylpent-3-en-2-one |
Wiley ID |
1342837 |