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(1R,5R,7R)-5-(Hydroxymethyl)-8(E)-(iodomethylene)-7-methoxy-6-oxa-cis-bicyclo[3.3.0]oct-3-en-2-one
SpectraBase Compound ID 9Jv0K0YgAL6
InChI InChI=1S/C10H11IO4/c1-14-9-6(4-11)8-7(13)2-3-10(8,5-12)15-9/h2-4,8-9,12H,5H2,1H3/b6-4-/t8-,9+,10-/m0/s1
InChIKey WHXQIHMSFNHAOE-MSWXNHAGSA-N
Mol Weight 322.1 g/mol
Molecular Formula C10H11IO4
Exact Mass 321.970204 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4RJkZIhVjTT
Name (1R,5R,7R)-5-(Hydroxymethyl)-8(E)-(iodomethylene)-7-methoxy-6-oxa-cis-bicyclo[3.3.0]oct-3-en-2-one
CAS Registry Number 115960-72-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H11IO4
InChI InChI=1S/C10H11IO4/c1-14-9-6(4-11)8-7(13)2-3-10(8,5-12)15-9/h2-4,8-9,12H,5H2,1H3/b6-4-/t8-,9+,10-/m0/s1
InChIKey WHXQIHMSFNHAOE-MSWXNHAGSA-N
Molecular Weight 322.098 g/mol
SMILES OC[C@]12[C@@](\C([C@@](O2)(OC)[H])=C\I)(C(C=C1)=O)[H]
SPLASH splash10-000i-0900000000-a33eabadf63489d8e192
Source of Spectrum C-112-3504-41
Synonyms (2R,3Z,3aR,6aR)-6a-(hydroxymethyl)-3-(iodomethylene)-2-methoxy-2,3,3a,6a-tetrahydro-4H-cyclopenta[b]furan-4-one
Wiley ID 1321221