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5-Methoxytricyclo[4.1.0.0(1,3)]heptan-4-one
SpectraBase Compound ID HCILmnDVR3J
InChI InChI=1S/C8H10O2/c1-10-7-5-3-8(5)2-4(8)6(7)9/h4-5,7H,2-3H2,1H3/t4-,5-,7?,8?/m1/s1
InChIKey ZMSQQVWHAXXNJJ-DYMZIKSMSA-N
Mol Weight 138.17 g/mol
Molecular Formula C8H10O2
Exact Mass 138.06808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F1oGmj6V5hJ
Name 5-Methoxytricyclo[4.1.0.0(1,3)]heptan-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H10O2
InChI InChI=1S/C8H10O2/c1-10-7-5-3-8(5)2-4(8)6(7)9/h4-5,7H,2-3H2,1H3/t4-,5-,7?,8?/m1/s1
InChIKey ZMSQQVWHAXXNJJ-DYMZIKSMSA-N
Molecular Weight 138.166 g/mol
SMILES C123[C@](C(=O)C([C@@]3([H])C1)OC)([H])C2
SPLASH splash10-05r9-9300000000-a90641aa1798932d89c4
Source of Spectrum J-63-1399-26
Synonyms (3S,6S)-5-Methoxy-3,6-dimethyl-tricyclo[4.1.0.0*1,3*]heptan-4-one
Wiley ID 1137895