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2-Methylethanoadamantane
SpectraBase Compound ID G1rwZskf42A
InChI InChI=1S/C13H20/c1-12-2-3-13(12)7-9-4-10(8-13)6-11(12)5-9/h9-11H,2-8H2,1H3/t9-,10+,11-,12?,13+
InChIKey OTJKDMRZHRECIX-UHFFFAOYSA-N
Mol Weight 176.3 g/mol
Molecular Formula C13H20
Exact Mass 176.156501 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BVFqDh0DoVv
Name 4,1,6-[1,2,3]Propanetriyl-1H-indene, octahydro-7a-methyl-
CAS Registry Number 72708-47-5
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20
InChI InChI=1S/C13H20/c1-12-2-3-13(12)7-9-4-10(8-13)6-11(12)5-9/h9-11H,2-8H2,1H3/t9-,10+,11-,12?,13+
InChIKey OTJKDMRZHRECIX-UHFFFAOYSA-N
Molecular Weight 176.303 g/mol
SMILES [C@]123C([C@@]4(C[C@@](C3)(C[C@@](C1)(C4)[H])[H])[H])(C)CC2
SPLASH splash10-004i-4900000000-9958de50ed887a77c280
Source of Spectrum J-45-990-0
Synonyms 2-Methylethanoadamantane 4-Methyltetracyclo[5.3.1.1(5,9).0(1,4)]dodecane
Wiley ID 1172896