For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(3aR*,7aR*)-5-Iodo-2,2,7a-trimethyl-3a,4,7,7a-tetrahydro-1,3-benzodioxol-4-one
SpectraBase Compound ID 6lHKtV4outy
InChI InChI=1S/C10H13IO3/c1-9(2)13-8-7(12)6(11)4-5-10(8,3)14-9/h4,8H,5H2,1-3H3/t8-,10+/m0/s1
InChIKey MZFPGVVACSABGW-WCBMZHEXSA-N
Mol Weight 308.12 g/mol
Molecular Formula C10H13IO3
Exact Mass 307.990939 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 2BYN08T6clF
Name (3aR*,7aR*)-5-Iodo-2,2,7a-trimethyl-3a,4,7,7a-tetrahydro-1,3-benzodioxol-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H13IO3
InChI InChI=1S/C10H13IO3/c1-9(2)13-8-7(12)6(11)4-5-10(8,3)14-9/h4,8H,5H2,1-3H3/t8-,10+/m0/s1
InChIKey MZFPGVVACSABGW-WCBMZHEXSA-N
Molecular Weight 308.115 g/mol
SMILES [C@]12([C@](OC(O2)(C)C)(CC=C(C1=O)I)C)[H]
SPLASH splash10-0api-0397000000-d40841e0d082f18d2de7
Source of Spectrum J-67-834-13
Synonyms (3aR,7aR)-5-iodo-2,2,7a-trimethyl-7,7a-dihydro-1,3-benzodioxol-4(3aH)-one (3aR,7aR)-5-iodanyl-2,2,7a-trimethyl-3a,7-dihydro-1,3-benzodioxol-4-one
Wiley ID 1569069