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4-(Hydroxymethyl)adamantan-2-one
SpectraBase Compound ID 2WmalFY8aTP
InChI InChI=1S/C11H16O2/c12-5-10-7-1-6-2-8(4-7)11(13)9(10)3-6/h6-10,12H,1-5H2/t6-,7+,8-,9+,10?/m0/s1
InChIKey DYGZHKHTWLUFFC-FLZHQEHWSA-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 EG6pUgC82cL
Name 4-(Hydroxymethyl)adamantan-2-one
Alternate Name(s) Tricyclo[3.3.1.1(3,7)]decan-2-one, 4-(hydroxymethyl)-, (1.alpha.,3.beta.,4.beta.,5.alpha.,7.beta.)- 4-(Hydroxymethyl)-2-adamantanone 4-Methyloladamantan-2-one Tricyclo[3.3.1.1(3,7)]decanone, 4-(hydroxymethyl)-, (1.alpha.,3.beta.,4.beta.,5.alpha.,7.beta.)-
CAS Registry Number 56781-91-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16O2
InChI InChI=1S/C11H16O2/c12-5-10-7-1-6-2-8(4-7)11(13)9(10)3-6/h6-10,12H,1-5H2/t6-,7+,8-,9+,10?/m0/s1
InChIKey DYGZHKHTWLUFFC-FLZHQEHWSA-N
Molecular Weight 180.247 g/mol
SMILES OCC1[C@@]2(C(=O)[C@@]3(C[C@]1(C[C@](C2)(C3)[H])[H])[H])[H]
SPLASH splash10-020v-4900000000-9ab97a7529f408896ee7
Source of Spectrum J-56-1705-8
Wiley ID 1176618