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2,5,7-TRIMETHYL-INDAN-1-ONE
SpectraBase Compound ID InGbbsrmsCb
InChI InChI=1S/C12H14O/c1-7-4-8(2)11-10(5-7)6-9(3)12(11)13/h4-5,9H,6H2,1-3H3
InChIKey YACBQDSJEQTNRJ-UHFFFAOYSA-N
Mol Weight 174.24 g/mol
Molecular Formula C12H14O
Exact Mass 174.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BqVWOnsIGLM
Name 2,5,7-Trimethyl-1-indanone
CAS Registry Number 65001-59-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14O
InChI InChI=1S/C12H14O/c1-7-4-8(2)11-10(5-7)6-9(3)12(11)13/h4-5,9H,6H2,1-3H3
InChIKey YACBQDSJEQTNRJ-UHFFFAOYSA-N
Molecular Weight 174.243 g/mol
SMILES c12C(C(C)Cc2cc(cc1C)C)=O
SPLASH splash10-0ab9-0900000000-3c5833f4ed8f000d99be
Source of Spectrum H-60-2057-0
Synonyms 2,5,7-trimethyl-2,3-dihydroinden-1-one
Wiley ID 1170987