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3-Butyl-1H-indene
SpectraBase Compound ID HjTgF5GmWxf
InChI InChI=1S/C13H16/c1-2-3-6-11-9-10-12-7-4-5-8-13(11)12/h4-5,7-9H,2-3,6,10H2,1H3
InChIKey XSXQCNPTMDUCFF-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 IO7bxMjjqA7
Name 3-Butyl-1H-indene
CAS Registry Number 2294-88-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16
InChI InChI=1S/C13H16/c1-2-3-6-11-9-10-12-7-4-5-8-13(11)12/h4-5,7-9H,2-3,6,10H2,1H3
InChIKey XSXQCNPTMDUCFF-UHFFFAOYSA-N
Molecular Weight 172.271 g/mol
SMILES C1(=CCc2c1cccc2)CCCC
SPLASH splash10-003r-0900000000-017a19c8f83269ffc559
Source of Spectrum J-49-4231-0
Wiley ID 1169475