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5-(Hydroxymethylene)-(trans)-4-caranone
SpectraBase Compound ID 8xwI9qlhnET
InChI InChI=1S/C11H16O2/c1-6-4-8-9(11(8,2)3)7(5-12)10(6)13/h5-6,8-9,12H,4H2,1-3H3/b7-5-/t6?,8-,9-/m0/s1
InChIKey OHISCRKDZFHDGZ-NRAWBFHDSA-N
Mol Weight 180.25 g/mol
Molecular Formula C11H16O2
Exact Mass 180.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3SSXS2Kvo8Y
Name 5-(Hydroxymethylene)-(trans)-4-caranone
Alternate Name(s) (1S,2Z,6S)-2-(hydroxymethylene)-4,7,7-trimethylbicyclo[4.1.0]heptan-3-one 2-(Hydroxymethylene)-4,7,7-trimethylbicyclo[4.1.0]heptan-3-one
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Formula C11H16O2
InChI InChI=1S/C11H16O2/c1-6-4-8-9(11(8,2)3)7(5-12)10(6)13/h5-6,8-9,12H,4H2,1-3H3/b7-5-/t6?,8-,9-/m0/s1
InChIKey OHISCRKDZFHDGZ-NRAWBFHDSA-N
Molecular Weight 180.247 g/mol
SMILES O\C=C\1[C@@]2(C(C)(C)[C@]2(CC(C1=O)C)[H])[H]
SPLASH splash10-00kf-9800000000-86804a5a8d5e74f976d7
Source of Spectrum SB-45-395-6
Wiley ID 744888