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2-Allyl-4-(2-chloroethoxy)-4,5-methylenedioxycyclohexa-2,5-dienone
SpectraBase Compound ID CndXgDAjJKO
InChI InChI=1S/C12H13ClO4/c1-2-3-9-7-12(16-5-4-13)11(6-10(9)14)15-8-17-12/h2,6-7H,1,3-5,8H2
InChIKey HBPIDTAALFVDSW-UHFFFAOYSA-N
Mol Weight 256.68 g/mol
Molecular Formula C12H13ClO4
Exact Mass 256.050237 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A2Pw61oW9Jg
Name 2-Allyl-4-(2-chloroethoxy)-4,5-methylenedioxycyclohexa-2,5-dienone
Alternate Name(s) 6-Allyl-7a-(2-chloroethoxy)-1,3-benzodioxol-5(7aH)-one
CAS Registry Number 67271-92-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13ClO4
InChI InChI=1S/C12H13ClO4/c1-2-3-9-7-12(16-5-4-13)11(6-10(9)14)15-8-17-12/h2,6-7H,1,3-5,8H2
InChIKey HBPIDTAALFVDSW-UHFFFAOYSA-N
Molecular Weight 256.685 g/mol
SMILES C12(C(=CC(C(=C2)CC=C)=O)OCO1)OCCCl
SPLASH splash10-00kf-7920000000-86202033448be2cf75e8
Source of Spectrum J-43-3984-0
Wiley ID 1259376