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2-Isopropyl-6,6-dimethyl-1-phenylhept-4-yne-1,2-diol
SpectraBase Compound ID 7vtPGQNKs7Z
InChI InChI=1S/C18H26O2/c1-14(2)18(20,13-9-12-17(3,4)5)16(19)15-10-7-6-8-11-15/h6-8,10-11,14,16,19-20H,13H2,1-5H3
InChIKey NLZCGVRJXAQSCP-UHFFFAOYSA-N
Mol Weight 274.4 g/mol
Molecular Formula C18H26O2
Exact Mass 274.19328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EhW946AATP8
Name 2-Isopropyl-6,6-dimethyl-1-phenylhept-4-yne-1,2-diol
Alternate Name(s) 2-isopropyl-6,6-dimethyl-1-phenyl-4-heptyne-1,2-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H26O2
InChI InChI=1S/C18H26O2/c1-14(2)18(20,13-9-12-17(3,4)5)16(19)15-10-7-6-8-11-15/h6-8,10-11,14,16,19-20H,13H2,1-5H3
InChIKey NLZCGVRJXAQSCP-UHFFFAOYSA-N
Molecular Weight 274.404 g/mol
SMILES OC(C(O)c1ccccc1)(CC#CC(C)(C)C)C(C)C
SPLASH splash10-0006-9200000000-adaa0a314f16dfb61651
Source of Spectrum U1-1998-2166-11
Wiley ID 751881