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1,7,7-trimethyl-3-(1-piperidylmethyl)norbornan-2-one
SpectraBase Compound ID HeBQVInCrBs
InChI InChI=1S/C16H27NO/c1-15(2)13-7-8-16(15,3)14(18)12(13)11-17-9-5-4-6-10-17/h12-13H,4-11H2,1-3H3/t12?,13-,16+/m1/s1
InChIKey BPUVTPQEHYIPFV-QVNUIZJESA-N
Mol Weight 249.4 g/mol
Molecular Formula C16H27NO
Exact Mass 249.209264 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BgnqxdXBOFc
Name 1,7,7-trimethyl-3-(1-piperidylmethyl)norbornan-2-one
Alternate Name(s) 1,7,7-trimethyl-3-(piperidinomethyl)norbornan-2-one 4,7,7-trimethyl-2-(1-piperidinylmethyl)-3-bicyclo[2.2.1]heptanone 4,7,7-trimethyl-2-(piperidin-1-ylmethyl)bicyclo[2.2.1]heptan-3-one
CAS Registry Number 37747-58-3
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H27NO
InChI InChI=1S/C16H27NO/c1-15(2)13-7-8-16(15,3)14(18)12(13)11-17-9-5-4-6-10-17/h12-13H,4-11H2,1-3H3/t12?,13-,16+/m1/s1
InChIKey BPUVTPQEHYIPFV-QVNUIZJESA-N
Molecular Weight 249.398 g/mol
SMILES [C@@]12(C(C(CN3CCCCC3)[C@](C1(C)C)(CC2)[H])=O)C
SPLASH splash10-0002-9000000000-0256b6df192fbaa056e8
Source of Spectrum F-46-994-11
Wiley ID 1252424