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Butanoic acid, 2,2-dimethyl-4-[(phenylmethyl)seleno]-
SpectraBase Compound ID 94XrHGLPGXj
InChI InChI=1S/C13H18O2Se/c1-13(2,12(14)15)8-9-16-10-11-6-4-3-5-7-11/h3-7H,8-10H2,1-2H3,(H,14,15)
InChIKey XJFJVDTZZCVMRX-UHFFFAOYSA-N
Mol Weight 285.26 g/mol
Molecular Formula C13H18O2Se
Exact Mass 286.047202 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5cgFnrxBpTM
Name Butanoic acid, 2,2-dimethyl-4-[(phenylmethyl)seleno]-
CAS Registry Number 3709-09-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O2Se
InChI InChI=1S/C13H18O2Se/c1-13(2,12(14)15)8-9-16-10-11-6-4-3-5-7-11/h3-7H,8-10H2,1-2H3,(H,14,15)
InChIKey XJFJVDTZZCVMRX-UHFFFAOYSA-N
Molecular Weight 285.257 g/mol
SMILES OC(C(C)(C)CC[Se]Cc1ccccc1)=O
SPLASH splash10-0006-9100000000-04bcea36b27f1ecf3080
Source of Spectrum N-30-557-6
Synonyms 4-(Benzylselanyl)-2,2-dimethylbutanoic acid 2,2-Dimethyl-4-(phenylmethyl)selanyl-butanoic acid 2,2-Dimethyl-4-[(phenylmethyl)seleno]butanoic acid 4-(benzylseleno)-2,2-dimethyl-butyric acid Butyric acid, 4-(benzylselenyl)-2,2-dimethyl- 4-Benzylselanyl-2,2-dimethylbutanoic acid
Wiley ID 1289450