SpectraBase Spectrum ID |
J77mCtaIljC |
Name |
Sesamol |
Source of Sample |
SAFC Cat.no. S3003 |
CAS Registry Number |
533-31-3 |
Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
Exact Mass |
138.031694050 u |
Formula |
C7H6O3 |
InChI |
InChI=1S/C7H6O3/c8-5-1-2-6-7(3-5)10-4-9-6/h1-3,8H,4H2 |
InChIKey |
LUSZGTFNYDARNI-UHFFFAOYSA-N |
Molecular Weight |
138.122 g/mol |
Number of Peaks |
47 |
RI1 |
1318 |
RI2 |
995 |
SMILES |
Oc1ccc2c(c1)OCO2 |
SPLASH |
splash10-000i-6900000000-7e8ebf8ed26926826278 |
Sample Comments |
RI1: measured on SLB-5ms (Hydro)
RI2: measured on SLB-5ms (FAMEs)
RI3: measured on Supelcowax-10 (FAMEs)
RI4: measured on Supelcowax-10 (FAEEs)
RI5: measured on Equity-1 (Hydro) |
Source of Spectrum |
Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy) |
Synonyms |
1,3-Benzodioxol-5-ol |
Wiley ID |
LM_FFNSC3_1864 |