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alpha-THUJEN
SpectraBase Compound ID 1wIkxHmLD3U
InChI InChI=1S/C10H16/c1-7(2)10-5-4-8(3)9(10)6-10/h4,7,9H,5-6H2,1-3H3
InChIKey KQAZVFVOEIRWHN-UHFFFAOYSA-N
Mol Weight 136.24 g/mol
Molecular Formula C10H16
Exact Mass 136.125201 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2BJUxhRudvE
Name 3-Thujene
Alternate Name(s) Bicyclo[3.1.0]hex-2-ene, 2-methyl-5-(1-methylethyl)- 5-Isopropyl-2-methylbicyclo[3.1.0]hex-2-ene .alpha.-Thujene Bicyclo(3.1.0)hex-2-ene, 2-methyl-5-(1-methylethyl)- Origanene 4-Methyl-1-propan-2-ylbicyclo[3.1.0]hex-3-ene 4-Methyl-1-propan-2-yl-bicyclo[3.1.0]hex-3-ene EINECS 220-686-7
CAS Registry Number 2867-05-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H16
InChI InChI=1S/C10H16/c1-7(2)10-5-4-8(3)9(10)6-10/h4,7,9H,5-6H2,1-3H3
InChIKey KQAZVFVOEIRWHN-UHFFFAOYSA-N
Molecular Weight 136.238 g/mol
SMILES CC=1C2CC2(C(C)C)CC1
SPLASH splash10-0006-9000000000-61066b552615170973a0
Source of Spectrum AA-0-703-1
Wiley ID 1136880