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1,3-Methanocyclopenta[cd]pentalen-6(1H)-one, octahydro-1-methoxy-
SpectraBase Compound ID 2JDmNLHuTe6
InChI InChI=1S/C12H16O2/c1-14-12-4-7-2-6-3-9(13)11(12)10(6)8(7)5-12/h6-8,10-11H,2-5H2,1H3/t6?,7-,8+,10?,11?,12-/m1/s1
InChIKey MCHBPBIDDWTYSV-QLCAYVMNSA-N
Mol Weight 192.26 g/mol
Molecular Formula C12H16O2
Exact Mass 192.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KiTkSpsq3WP
Name 1,3-Methanocyclopenta[cd]pentalen-6(1H)-one, octahydro-1-methoxy-
CAS Registry Number 86544-15-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O2
InChI InChI=1S/C12H16O2/c1-14-12-4-7-2-6-3-9(13)11(12)10(6)8(7)5-12/h6-8,10-11H,2-5H2,1H3/t6?,7-,8+,10?,11?,12-/m1/s1
InChIKey MCHBPBIDDWTYSV-QLCAYVMNSA-N
Molecular Weight 192.258 g/mol
SMILES [C@]12(C3C4C(C[C@](C2)([C@@]4(C1)[H])[H])CC3=O)OC
SPLASH splash10-0a4m-2900000000-ad22ff01f313ee1d19b0
Source of Spectrum J-50-5540-11
Synonyms 10-Methoxytetracyclo[6.3.0.0(2,6).0(3,10)]undecan-4-one 5-Methoxy-tetracyclo[4.2.1.0(3,5).0(9,10)]]undecan-7-one
Wiley ID 1188722