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(2S,5R)-2-Isopropyl-5methylhept-6-en-1-ol
SpectraBase Compound ID IGNKTcSOTjs
InChI InChI=1S/C11H22O/c1-5-10(4)6-7-11(8-12)9(2)3/h5,9-12H,1,6-8H2,2-4H3/t10-,11+/m0/s1
InChIKey GEJNIPPIOPOSDZ-WDEREUQCSA-N
Mol Weight 170.3 g/mol
Molecular Formula C11H22O
Exact Mass 170.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EcnvGxq5DWl
Name (2S,5R)-2-Isopropyl-5methylhept-6-en-1-ol
Alternate Name(s) (2S,5R)-2-isopropyl-5-methyl-6-hepten-1-ol
CAS Registry Number 126580-59-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H22O
InChI InChI=1S/C11H22O/c1-5-10(4)6-7-11(8-12)9(2)3/h5,9-12H,1,6-8H2,2-4H3/t10-,11+/m0/s1
InChIKey GEJNIPPIOPOSDZ-WDEREUQCSA-N
Molecular Weight 170.296 g/mol
SMILES OC[C@@](CC[C@](C=C)(C)[H])(C(C)C)[H]
SPLASH splash10-0apl-9000000000-dd737c8d23bae3fb6499
Source of Spectrum J-55-3915-12
Wiley ID 1167491