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1,3-Butadien-1-ol, 3-methyl-, acetate
SpectraBase Compound ID 9VX9Ns6UHn9
InChI InChI=1S/C7H10O2/c1-6(2)4-5-9-7(3)8/h4-5H,1H2,2-3H3/b5-4+
InChIKey KRROLIZNADPOLD-SNAWJCMRSA-N
Mol Weight 126.15 g/mol
Molecular Formula C7H10O2
Exact Mass 126.06808 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EDgbbrgOFkO
Name 3-METHYL-1,3-BUTADIEN-1-OL, ACETATE
Source of Sample R. Rupprecht, W. Bremser BASF Ludwigshafen (1980)
CAS Registry Number 17616-47-6
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H10O2
InChI InChI=1S/C7H10O2/c1-6(2)4-5-9-7(3)8/h4-5H,1H2,2-3H3/b5-4+
InChIKey KRROLIZNADPOLD-SNAWJCMRSA-N
Molecular Weight 126.16
Solvent Chloroform-d; Reference=TMS; Temperature=Ambient Spectrometer= Bruker WP-80
Synonyms 1,3-BUTADIEN-1-OL, 3-METHYL-, ACETATE