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1-isopropoxyhept-2-ynylbenzene
SpectraBase Compound ID 4HQehqfCT0e
InChI InChI=1S/C16H22O/c1-4-5-6-10-13-16(17-14(2)3)15-11-8-7-9-12-15/h7-9,11-12,14,16H,4-6H2,1-3H3
InChIKey ZBCOQRALJFSIEA-UHFFFAOYSA-N
Mol Weight 230.35 g/mol
Molecular Formula C16H22O
Exact Mass 230.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6FefwTB9N1Q
Name 1-isopropoxyhept-2-ynylbenzene
Alternate Name(s) 1-Phenyl-1-isopropoxyhep-2-yne 1-Propan-2-yloxyhept-2-ynylbenzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22O
InChI InChI=1S/C16H22O/c1-4-5-6-10-13-16(17-14(2)3)15-11-8-7-9-12-15/h7-9,11-12,14,16H,4-6H2,1-3H3
InChIKey ZBCOQRALJFSIEA-UHFFFAOYSA-N
Molecular Weight 230.351 g/mol
SMILES C(#CCCCC)C(OC(C)C)c1ccccc1
SPLASH splash10-0a6u-8900000000-e3344092b0ad6833b382
Source of Spectrum AT-40-5990-2
Wiley ID 854618