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2-(Hydroxymethyl)-2,4,5-trimethyl-indan-1-one
SpectraBase Compound ID 55fN117uu68
InChI InChI=1S/C13H16O2/c1-8-4-5-10-11(9(8)2)6-13(3,7-14)12(10)15/h4-5,14H,6-7H2,1-3H3
InChIKey JMZPGXXXBZUAFD-UHFFFAOYSA-N
Mol Weight 204.27 g/mol
Molecular Formula C13H16O2
Exact Mass 204.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5nSJMT34zma
Name 2-(Hydroxymethyl)-2,4,5-trimethyl-indan-1-one
Alternate Name(s) 2-(hydroxymethyl)-2,4,5-trimethyl-1-indanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O2
InChI InChI=1S/C13H16O2/c1-8-4-5-10-11(9(8)2)6-13(3,7-14)12(10)15/h4-5,14H,6-7H2,1-3H3
InChIKey JMZPGXXXBZUAFD-UHFFFAOYSA-N
Molecular Weight 204.269 g/mol
SMILES OCC1(C(c2c(C1)c(c(cc2)C)C)=O)C
SPLASH splash10-0kmr-0920000000-ed3c476bdb036bba9841
Source of Spectrum C-88-3114-19
Wiley ID 1590512