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4-Isopropyl-5-methyl-2-hexyne-1,4-diol
SpectraBase Compound ID ASPQLNmPn57
InChI InChI=1S/C10H18O2/c1-8(2)10(12,9(3)4)6-5-7-11/h8-9,11-12H,7H2,1-4H3
InChIKey HRSMSCVQDVMVAT-UHFFFAOYSA-N
Mol Weight 170.25 g/mol
Molecular Formula C10H18O2
Exact Mass 170.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2T6zMFdiGu
Name 4-Isopropyl-5-methyl-2-hexyne-1,4-diol
Alternate Name(s) 4-Isopropyl-5-methylhex-2-yne-1,4-diol 5-Methyl-4-propan-2-yl-2-hexyne-1,4-diol 5-Methyl-4-propan-2-yl-hex-2-yne-1,4-diol 5-Methyl-4-propan-2-ylhex-2-yne-1,4-diol
CAS Registry Number 70372-89-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H18O2
InChI InChI=1S/C10H18O2/c1-8(2)10(12,9(3)4)6-5-7-11/h8-9,11-12H,7H2,1-4H3
InChIKey HRSMSCVQDVMVAT-UHFFFAOYSA-N
Molecular Weight 170.252 g/mol
SMILES OC(C#CCO)(C(C)C)C(C)C
SPLASH splash10-002f-9300000000-87c7f60379f20b92ef6b
Wiley ID 1483931