SpectraBase Spectrum ID |
GLa0x3sPmxe |
Name |
PYRANOCOUMARINE |
CAS Registry Number |
518-20-7 |
Copyright |
Database Compilation Copyright © 2023-2025 John Wiley and Sons, Inc. Copyright © 2023-2025 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
Exact Mass |
322.120509056 u |
Formula |
C20H18O4 |
InChI |
InChI=1S/C20H18O4/c1-20(22-2)12-15(13-8-4-3-5-9-13)17-18(24-20)14-10-6-7-11-16(14)23-19(17)21/h3-11,15H,12H2,1-2H3 |
InChIKey |
ZGFASEKBKWVCGP-UHFFFAOYSA-N |
Molecular Weight |
322.360 g/mol |
Nominal Mass |
322 u |
Number of Peaks |
110 |
SMILES |
CC1(CC(c2ccccc2)C2=C(c3ccccc3OC2=O)O1)OC |
SPLASH |
splash10-00di-7592000000-0a9ca60593f655869677 |
Source of Spectrum |
Dr. Rolf Kuehnle |
Synonyms |
2-methoxy-2-methyl-4-phenyl-3,4-dihydro-2H,5H-pyrano[3,2-c]chromen-5-one |
Technique |
GC/MS |
Wiley ID |
WID_MSPA_4098 |