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2,2,4,6,6-pentamethyl-7,7a-dihydro-1,3-benzodioxol-5-one
SpectraBase Compound ID ByRsY3gOq0y
InChI InChI=1S/C12H18O3/c1-7-9-8(14-12(4,5)15-9)6-11(2,3)10(7)13/h8H,6H2,1-5H3
InChIKey XNMQNTGJBBMQIX-UHFFFAOYSA-N
Mol Weight 210.27 g/mol
Molecular Formula C12H18O3
Exact Mass 210.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2OaI4qmvUI9
Name 2,2,4,6,6-pentamethyl-7,7a-dihydro-1,3-benzodioxol-5-one
CAS Registry Number 74601-71-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O3
InChI InChI=1S/C12H18O3/c1-7-9-8(14-12(4,5)15-9)6-11(2,3)10(7)13/h8H,6H2,1-5H3
InChIKey XNMQNTGJBBMQIX-UHFFFAOYSA-N
Molecular Weight 210.273 g/mol
SMILES C12=C(C(=O)C(CC2OC(O1)(C)C)(C)C)C
SPLASH splash10-0f8c-9610000000-441a921d1bdd80a7ab2c
Source of Spectrum H-64-2442-0
Wiley ID 1209160