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1,4-dimethyl-isopropylazulene
SpectraBase Compound ID CIxh2NRBsL8
InChI InChI=1S/C15H18/c1-10(2)13-7-5-11(3)14-8-6-12(4)15(14)9-13/h5-10H,1-4H3
InChIKey FWKQNCXZGNBPFD-UHFFFAOYSA-N
Mol Weight 198.31 g/mol
Molecular Formula C15H18
Exact Mass 198.140851 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Am8oH8Cy5TX
Name Guaiazulene
Carrier Gas Helium (1 mL/min)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 198.140850580 u
Formula C15H18
GC Column HP-5MS (30 m x 0.25 mm, film thickness 0.25 micrometer)
GC Oven Program Oven temp 310oC
InChI InChI=1S/C15H18/c1-10(2)13-7-5-11(3)14-8-6-12(4)15(14)9-13/h5-10H,1-4H3
InChIKey FWKQNCXZGNBPFD-UHFFFAOYSA-N
Inlet Type Split (10:1)
Instrument Name Agilent Technologies 7890B-5077A
Ionization Type EI
Literature Reference DOI 10.1002/jssc.201700072
Molecular Weight 198.309 g/mol
Quality 909
SMILES C=1(C=CC(=C2C(C1)=C(C=C2)C)C)C(C)C
SPLASH splash10-001j-1900000000-6d66174264b582129b27
Source of Spectrum SEP-40-2678-GA (DOI: 10.1002/jssc.201700072)
Wiley ID 1904401