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Bicyclo[2.2.1]heptan-2-ol, 1,7,7-trimethyl-3-(phenylmethylene)-, (1.alpha.,2.alpha.,4.alpha.)-
SpectraBase Compound ID JYNMUEgKaBa
InChI InChI=1S/C17H22O/c1-16(2)14-9-10-17(16,3)15(18)13(14)11-12-7-5-4-6-8-12/h4-8,11,14-15,18H,9-10H2,1-3H3/b13-11+/t14-,15-,17+/m0/s1
InChIKey NPHOQLBSOQBVHQ-ZCXXQYKCSA-N
Mol Weight 242.36 g/mol
Molecular Formula C17H22O
Exact Mass 242.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L34hQ82MlDw
Name Bicyclo[2.2.1]heptan-2-ol, 1,7,7-trimethyl-3-(phenylmethylene)-, (1.alpha.,2.alpha.,4.alpha.)-
Alternate Name(s) (3E)-3-benzylidene-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol 3-Benzylidene isoborneol
CAS Registry Number 38108-48-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22O
InChI InChI=1S/C17H22O/c1-16(2)14-9-10-17(16,3)15(18)13(14)11-12-7-5-4-6-8-12/h4-8,11,14-15,18H,9-10H2,1-3H3/b13-11+/t14-,15-,17+/m0/s1
InChIKey NPHOQLBSOQBVHQ-ZCXXQYKCSA-N
Molecular Weight 242.362 g/mol
SMILES O[C@@]1([C@]2(CC[C@](C2(C)C)(\C1=C\c1ccccc1)[H])C)[H]
SPLASH splash10-001l-6910000000-7eb523078754523b4edc
Source of Spectrum EP-6827-0-0
Wiley ID 1245644