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2,4,7-Metheno-1H-cyclopenta[a]pentalen-3-ol, 4-bromodecahydro-, (2.alpha.,3a.beta.,3b.beta.,4.beta.,6a.beta.,7.alpha.,7a.beta.,8S*)-
SpectraBase Compound ID KsAzuxAskMx
InChI InChI=1S/C12H15BrO/c13-12-2-1-4-7-5-3-6(10(7)12)11(14)8(5)9(4)12/h4-11,14H,1-3H2/t4-,5+,6+,7-,8+,9-,10+,11?,12+/m0/s1
InChIKey SALFRWKQPOKRQG-MWWKXYDUSA-N
Mol Weight 255.15 g/mol
Molecular Formula C12H15BrO
Exact Mass 254.030628 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 34kXR9492H2
Name 2,4,7-Metheno-1H-cyclopenta[a]pentalen-3-ol, 4-bromodecahydro-, (2.alpha.,3a.beta.,3b.beta.,4.beta.,6a.beta.,7.alpha.,7a.beta.,8S*)-
CAS Registry Number 100672-73-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H15BrO
InChI InChI=1S/C12H15BrO/c13-12-2-1-4-7-5-3-6(10(7)12)11(14)8(5)9(4)12/h4-11,14H,1-3H2/t4-,5+,6+,7-,8+,9-,10+,11?,12+/m0/s1
InChIKey SALFRWKQPOKRQG-MWWKXYDUSA-N
Molecular Weight 255.155 g/mol
SMILES OC1[C@]2([C@]3([C@]4([C@]5([C@@]([H])([C@]3([H])CC4)[C@@]2([H])C[C@@]15[H])[H])Br)[H])[H]
SPLASH splash10-004i-0900000000-436fe48a6205b7f17de1
Source of Spectrum K-118-4995-35
Synonyms (1S,2S,3R,5S,7R,8S,10R)-10-bromopentacyclo[6.4.0.0(2,10).0(3,7).0(5,9)]dodecan-4-ol 10-Bromopentacyclo[6.4.0.0(2,10).0(3,7).0(5,9)]dodecan-exo-4-ol 4-Bromo-decahydro-2,4,7-metheno-1H-cyclopenta[a]pentalen-3.beta.-ol
Wiley ID 1257387