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3-Hydroxy-6-(2-hydroxyethyl)-5-(hydroxymethyl)-2,7-dimethyl-1-indanone
SpectraBase Compound ID Ijcsd0vCZ3G
InChI InChI=1S/C14H18O4/c1-7-10(3-4-15)9(6-16)5-11-12(7)14(18)8(2)13(11)17/h5,8,13,15-17H,3-4,6H2,1-2H3
InChIKey WOVQRZQIOSEMHW-UHFFFAOYSA-N
Mol Weight 250.29 g/mol
Molecular Formula C14H18O4
Exact Mass 250.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2S7qYK2ygtf
Name 3-Hydroxy-6-(2-hydroxyethyl)-5-(hydroxymethyl)-2,7-dimethyl-1-indanone
CAS Registry Number 56227-01-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O4
InChI InChI=1S/C14H18O4/c1-7-10(3-4-15)9(6-16)5-11-12(7)14(18)8(2)13(11)17/h5,8,13,15-17H,3-4,6H2,1-2H3
InChIKey WOVQRZQIOSEMHW-UHFFFAOYSA-N
Molecular Weight 250.294 g/mol
SMILES OCCc1c(cc2C(C(C(c2c1C)=O)C)O)CO
SPLASH splash10-0udi-0290000000-3f2d499e1fca1c36d1e1
Source of Spectrum W5-1989-32737-1
Synonyms 3-Hydroxy-6-(2-hydroxyethyl)-2,7-dimethyl-5-methylol-indan-1-one 3-Hydroxy-6-(2-hydroxyethyl)-5-(hydroxymethyl)-2,7-dimethyl-2,3-dihydroinden-1-one 3-Hydroxy-6-(2-hydroxyethyl)-5-(hydroxymethyl)-2,7-dimethyl-indan-1-one 6-(2-hydroxyethyl)-5-(hydroxymethyl)-2,7-dimethyl-3-oxidanyl-2,3-dihydroinden-1-one Pterosin T
Wiley ID 1253317