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3-tert-Butyl-1H-indene

View entire compound with spectra: 2 MS (GC)

3-tert-Butyl-1H-indene
SpectraBase Compound ID LN5NgRVDxp
InChI InChI=1S/C13H16/c1-13(2,3)12-9-8-10-6-4-5-7-11(10)12/h4-7,9H,8H2,1-3H3
InChIKey QKTNNHZEFGFOQG-UHFFFAOYSA-N
Mol Weight 172.27 g/mol
Molecular Formula C13H16
Exact Mass 172.125201 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CfPmdsbChiy
Name 3-tert-Butylindene
Alternate Name(s) 3-(tert-butyl)-1H-indene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16
InChI InChI=1S/C13H16/c1-13(2,3)12-9-8-10-6-4-5-7-11(10)12/h4-7,9H,8H2,1-3H3
InChIKey QKTNNHZEFGFOQG-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ejic.200400972
Molecular Weight 172.271 g/mol
SMILES C1c2ccccc2C(C(C)(C)C)=C1
SPLASH splash10-0a4i-2900000000-855df5b4b7ab07456ef3
Source of Spectrum U2-2005-1767-7
Wiley ID 1791100