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2,4-Adamantanediol, stereoisomer
SpectraBase Compound ID LX3NX3ajtti
InChI InChI=1S/C10H16O2/c11-9-6-1-5-2-7(4-6)10(12)8(9)3-5/h5-12H,1-4H2/t5?,6?,7?,8?,9-,10-/m0/s1
InChIKey PBWYCJIFRBPVPW-MXRGKJHESA-N
Mol Weight 168.24 g/mol
Molecular Formula C10H16O2
Exact Mass 168.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3JeKPgiDtx0
Name 2,4-Adamantanediol, stereoisomer
Alternate Name(s) Tricyclo[3.3.1.13,7]decane-2,4-diol, (1.alpha.,2.alpha.,3.beta.,4.alpha.,5.alpha.,7.beta.)- (2S,4S)-tricyclo[3.3.1.1(3,7)]decane-2,4-diol 2a,4a-dihydroxyadamantane Adamantane-2a,4a-diol
CAS Registry Number 28644-55-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H16O2
InChI InChI=1S/C10H16O2/c11-9-6-1-5-2-7(4-6)10(12)8(9)3-5/h5-12H,1-4H2/t5?,6?,7?,8?,9-,10-/m0/s1
InChIKey PBWYCJIFRBPVPW-MXRGKJHESA-N
Molecular Weight 168.236 g/mol
SMILES O[C@@]1(C2CC3CC([C@@]2(O)[H])CC1C3)[H]
SPLASH splash10-0ufr-5900000000-aad1d01328f0cf8ea0b2
Source of Spectrum F-38-986-0
Wiley ID 1164734