SpectraBase Spectrum ID |
Lqp9ghH5mJA |
Name |
3,6-heptanooxepin-4,5-dicarbonsaure-dimethylester |
CAS Registry Number |
102652-08-4 |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C17H22O5 |
InChI |
InChI=1S/C17H22O5/c1-20-16(18)14-12-8-6-4-3-5-7-9-13(11-22-10-12)15(14)17(19)21-2/h10-11H,3-9H2,1-2H3 |
InChIKey |
VHMPSQBYASXIPI-UHFFFAOYSA-N |
Molecular Weight |
306.358 g/mol |
SMILES |
C1(=C(C(=O)OC)C2=COC=C1CCCCCCC2)C(=O)OC |
SPLASH |
splash10-0a4i-0009000000-748d32442d5247041516 |
Source of Spectrum |
K-119-2709-1 |
Synonyms |
dimethyl 11-oxabicyclo[7.3.2]tetradeca-1(12),9,13-triene-13,14-dicarboxylate |
Wiley ID |
1308089 |