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4-Heptulose, 2,3:5,6-dianhydro-1,7-dideoxy-2-C-methyl-6-C-(4-methyl-3-cyclohexen-1-yl)-
SpectraBase Compound ID 58u49thIpTG
InChI InChI=1S/C15H22O3/c1-9-5-7-10(8-6-9)15(4)13(18-15)11(16)12-14(2,3)17-12/h5,10,12-13H,6-8H2,1-4H3
InChIKey NVAOVZXWNQXILY-UHFFFAOYSA-N
Mol Weight 250.34 g/mol
Molecular Formula C15H22O3
Exact Mass 250.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Z9uCAFKlc
Name 4-Heptulose, 2,3:5,6-dianhydro-1,7-dideoxy-2-C-methyl-6-C-(4-methyl-3-cyclohexen-1-yl)-
Alternate Name(s) 3-[(3,3-dimethyloxiran-2-yl)carbonyl]-2-methyl-2-(4-methylcyclohex-3-en-1-yl)oxirane Atlantone diepoxide
CAS Registry Number 41704-11-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22O3
InChI InChI=1S/C15H22O3/c1-9-5-7-10(8-6-9)15(4)13(18-15)11(16)12-14(2,3)17-12/h5,10,12-13H,6-8H2,1-4H3
InChIKey NVAOVZXWNQXILY-UHFFFAOYSA-N
Molecular Weight 250.338 g/mol
SMILES C1(C(C2CC=C(CC2)C)(C)O1)C(C1OC1(C)C)=O
SPLASH splash10-006x-9310000000-66b92881dd9f0e2c929d
Source of Spectrum F-33-1204-0
Wiley ID 1253566