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7-Acetyl-[1(2,3)4]-pentamantane
SpectraBase Compound ID 4BrLaEFqj1t
InChI InChI=1S/C28H34O/c1-14(29)22-11-26-8-15-2-23-4-16-5-25-7-17-6-24(3-15,18(23)25)20(26)28(10-17,13-22)21(25)27(9-16,12-22)19(23)26/h15-21H,2-13H2,1H3
InChIKey UBQYRBKBFIXOSY-UHFFFAOYSA-N
Mol Weight 386.6 g/mol
Molecular Formula C28H34O
Exact Mass 386.260966 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3rxI0338hFh
Name 7-Acetyl-[1(2,3)4]-pentamantane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H34O
InChI InChI=1S/C28H34O/c1-14(29)22-11-26-8-15-2-23-4-16-5-25-7-17-6-24(3-15,18(23)25)20(26)28(10-17,13-22)21(25)27(9-16,12-22)19(23)26/h15-21H,2-13H2,1H3
InChIKey UBQYRBKBFIXOSY-UHFFFAOYSA-N
Molecular Weight 386.579 g/mol
SMILES C123C4C56CC(C1)(C(=O)C)CC17C2C28C9C(CC(CC49CC(C3)C8)C5)(CC(C2)C1)C67
SPLASH splash10-000f-4689000000-e7a28c847caf1deeef88
Source of Spectrum U1-2009-5160-14
Wiley ID 1697238