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«3-Hexyl-1-hydroxy-7,8,9,10-tetrahydro-6,6,9-trimethyl-6/H-dibenzo[/b,/d]pyran»
CSA Names: 3-Hexyl-1-hydroxy-7,8,9,10-tetrahydro-6,6,9-trimethyl-6H-dibenzo[b,d]pyran
Parahexyl
Synhexyl
CSA Location: Schedule I Section (d) Subsection (25) DEA code 7374
CSA History: 47 FR 52432 added (and renumbered subsequent entries) effective 22 Dec 1982
Names: 3-Hexyl-6,6,9-trimethyl-7,8,9,10-tetrahydro-6H-benzo[c]chromen-1-ol (IUPAC)
Molecular formula: C22H32O2
Nominal mass: 328
Average mass: 328.4883
Monoisotopic mass: 328.240230
CAS registry number: 117-51-1
ChemSpider: 8031
PubChem: 8334
Wikipedia: Parahexyl
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Bluelight: Parahexyl
Standard InChI: InChI=1S/C22H32O2/c1-5-6-7-8-9-16-13-19(23)21-17-12-15(2)10-11-18(17)22(3,4)24-20(21)14-16/h13-15,23H,5-12H2,1-4H3
Standard InChI key: OORFXDSWECAQLI-UHFFFAOYSA-N
SMILES: CCCCCCc1cc(O)c2c(c1)OC(C1=C2CC(C)CC1)(C)C
Tags: USCSA
 
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Parahexyl (NIST).pdf EI MS Used with the permission of NIST Mass Spectrometry Data Center Collection (C) 2008 copyright by the U.S. Secretary of Commerce on behalf of the United States of America. All rights reserved.
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