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1,4,5,6-Tetrahydro-6-iodo-1,5,5-trimethyl-1-benzocine-2,3-dione
SpectraBase Compound ID IrITBgc8Phi
InChI InChI=1S/C14H16INO2/c1-14(2)8-11(17)13(18)16(3)10-7-5-4-6-9(10)12(14)15/h4-7,12H,8H2,1-3H3
InChIKey NXQDCXSSRLPVFV-UHFFFAOYSA-N
Mol Weight 357.19 g/mol
Molecular Formula C14H16INO2
Exact Mass 357.022574 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LjnTHETDELS
Name 1,4,5,6-Tetrahydro-6-iodo-1,5,5-trimethyl-1-benzocine-2,3-dione
CAS Registry Number 137793-12-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16INO2
InChI InChI=1S/C14H16INO2/c1-14(2)8-11(17)13(18)16(3)10-7-5-4-6-9(10)12(14)15/h4-7,12H,8H2,1-3H3
InChIKey NXQDCXSSRLPVFV-UHFFFAOYSA-N
Molecular Weight 357.191 g/mol
SMILES C1(N(c2c(C(C(CC1=O)(C)C)I)cccc2)C)=O
SPLASH splash10-03di-0960000000-6a9eb60f353291d351ef
Source of Spectrum J-57-605-0
Synonyms 6-iodo-1,5,5-trimethyl-1,4,5,6-tetrahydro-1-benzazocine-2,3-dione
Wiley ID 1346319