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4-Methyl-2-[(2E)-1-methyl-2-butenyl]phenol
SpectraBase Compound ID E2L95t5pIL1
InChI InChI=1S/C12H16O/c1-4-5-10(3)11-8-9(2)6-7-12(11)13/h4-8,10,13H,1-3H3/b5-4+
InChIKey REEVSMMNDPUOFK-SNAWJCMRSA-N
Mol Weight 176.26 g/mol
Molecular Formula C12H16O
Exact Mass 176.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5HkzbjhRx18
Name 4-Methyl-2-[(2E)-1-methyl-2-butenyl]phenol
Alternate Name(s) 4-Methyl-2-[(E)-1-methylbut-2-enyl]phenol 4-Methyl-2-[(E)-pent-3-en-2-yl]phenol Phenol, 2-(2-penten-4-yl)-4-methyl-
CAS Registry Number 13831-49-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O
InChI InChI=1S/C12H16O/c1-4-5-10(3)11-8-9(2)6-7-12(11)13/h4-8,10,13H,1-3H3/b5-4+
InChIKey REEVSMMNDPUOFK-SNAWJCMRSA-N
Molecular Weight 176.259 g/mol
SMILES Oc1c(cc(cc1)C)C(\C=C\C)C
SPLASH splash10-03fr-3900000000-13f4fa47366b90993147
Source of Spectrum AD-0-2532-0
Wiley ID 1419166