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(-)-PINANE
SpectraBase Compound ID AMzgJ76AJPK
InChI InChI=1S/C10H18/c1-7-4-5-8-6-9(7)10(8,2)3/h7-9H,4-6H2,1-3H3/t7-,8+,9+/m1/s1
InChIKey XOKSLPVRUOBDEW-VGMNWLOBSA-N
Mol Weight 138.25 g/mol
Molecular Formula C10H18
Exact Mass 138.140851 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IpLbzQ3auMQ
Name cis-Pinane
Alternate Name(s) Pinane
CAS Registry Number 6876-13-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H18
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 ??m film thickness)
GC Oven Program 60 ??C to 246 ??C at 3 ??C/min.
InChI InChI=1S/C10H18/c1-7-4-5-8-6-9(7)10(8,2)3/h7-9H,4-6H2,1-3H3/t7-,8+,9+/m1/s1
InChIKey XOKSLPVRUOBDEW-VGMNWLOBSA-N
Molecular Weight 138.254 g/mol
SMILES C[C@]1([C@@]2(C[C@](CC1)(C2(C)C)[H])[H])[H]
SPLASH splash10-05o4-9000000000-834be9f76fd1007b3834
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID 1887789