Information from the InChI

Name: Information from the InChI
License: https://www.nist.gov/open/copyright-fair-use-and-licensing-statements-srd-data-software-and-technical-series-publications#SRD

There are no matching entries in the database for this IUPAC International Chemical Identifier. The following information was obtained from the identifier.

Formula: C₁₃H₁₈O₃S
Molecular weight: 254.345
IUPAC Standard InChI:
- InChI=1S/C13H18O3S/c1-9(2)7-8-17-11-5-3-10(4-6-11)12(14)13(15)16/h3-6,9,13,15-16H,7-8H2,1-2H3
IUPAC Standard InChIKey: NJSYWZXMXREHIJ-UHFFFAOYSA-N
Connectivity:
2-d Mol File from the identifier
Canonical atom numbers:
Note: stereochemistry is currently not indicated in the items above.

Contents of the identifier

Identifier version: 1S

Main section

Formula: C13H18O3S
Connectivity: 1-9(2)7-8-17-11-5-3-10(4-6-11)12(14)13(15)16
Hydrogen: 3-6,9,13,15-16H,7-8H2,1-2H3