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(E)-3-BUTYLIDENEPHTHALIDE
SpectraBase Compound ID 8M926DUW5FN
InChI InChI=1S/C12H12O2/c1-2-3-8-11-9-6-4-5-7-10(9)12(13)14-11/h4-8H,2-3H2,1H3/b11-8+
InChIKey WMBOCUXXNSOQHM-DHZHZOJOSA-N
Mol Weight 188.23 g/mol
Molecular Formula C12H12O2
Exact Mass 188.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4LsdyKyKndR
Name E-Butylidenephthalide
Carrier Gas Helium (1.0 mL/min)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 188.083729624 u
Formula C12H12O2
GC Column HP-5MS (30 m x 0.25 mm, film thickness 0.25 micrometer)
GC Oven Program Oven temp 250oC
InChI InChI=1S/C12H12O2/c1-2-3-8-11-9-6-4-5-7-10(9)12(13)14-11/h4-8H,2-3H2,1H3/b11-8+
InChIKey WMBOCUXXNSOQHM-DHZHZOJOSA-N
Instrument Name Agilent 6890N GC-Agilent 5973N
Ionization Type EI
Literature Reference DOI 10.1002/jssc.200800332
Molecular Weight 188.226 g/mol
Quality 168
SMILES C1=2\C(=C/CCC)OC(C2C=CC=C1)=O
SPLASH splash10-0a4i-1900000000-ef0e9f6d341cec115333
Source of Spectrum SEP-31-3235-Peak no. 5 (DOI: 10.1002/jssc.200800332)
Wiley ID 1907968