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(1S,2R)-3-amylcyclohexa-3,5-diene-1,2-diol
SpectraBase Compound ID E2c8WSLM8rJ
InChI InChI=1S/C11H18O2/c1-2-3-4-6-9-7-5-8-10(12)11(9)13/h5,7-8,10-13H,2-4,6H2,1H3/t10-,11+/m0/s1
InChIKey QHBPDJRNUGYQDS-WDEREUQCSA-N
Mol Weight 182.26 g/mol
Molecular Formula C11H18O2
Exact Mass 182.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4gCR3GZF70K
Name (1S,2R)-3-amylcyclohexa-3,5-diene-1,2-diol
Alternate Name(s) (1S,2R)-3-pentylcyclohexa-3,5-diene-1,2-diol
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H18O2
InChI InChI=1S/C11H18O2/c1-2-3-4-6-9-7-5-8-10(12)11(9)13/h5,7-8,10-13H,2-4,6H2,1H3/t10-,11+/m0/s1
InChIKey QHBPDJRNUGYQDS-WDEREUQCSA-N
Molecular Weight 182.263 g/mol
SMILES O[C@]1(C=CC=C([C@]1(O)[H])CCCCC)[H]
SPLASH splash10-004i-0900000000-c46cfed3c66b81ba0c09
Source of Spectrum KC-0-1348-2
Wiley ID 830599