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cis-Pinene hydrate
SpectraBase Compound ID 7aNzNfSqAeg
InChI InChI=1S/C10H16.O/c1-7-4-5-8-6-9(7)10(8,2)3;/h8-9H,1,4-6H2,2-3H3;/t8-,9-;/m1./s1
InChIKey BOZVFRPCHRFNHZ-VTLYIQCISA-N
Mol Weight 152.24 g/mol
Molecular Formula C10H16O
Exact Mass 152.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KBQ2dQgeDUD
Name cis-Pinene hydrate
Alternate Name(s) (1S,5S)-6,6-dimethyl-2-methylenebicyclo[3.1.1]heptane hydrate
CAS Registry Number 35519-42-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H18O
InChI InChI=1S/C10H16.O/c1-7-4-5-8-6-9(7)10(8,2)3;/h8-9H,1,4-6H2,2-3H3;/t8-,9-;/m1./s1
InChIKey BOZVFRPCHRFNHZ-VTLYIQCISA-N
Molecular Weight 154.253 g/mol
SMILES O.[C@@]12(C(C)(C)[C@](C2)([H])CCC1=C)[H]
SPLASH splash10-0006-9100000000-00f70a9d852336037e05
Source of Spectrum UT-1990-579-0
Wiley ID 1152145