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2-Naphthalenecarboxylic acid, 1-butyl-1,2,3,4-tetrahydro-, methyl ester, cis-
SpectraBase Compound ID KDkDZ1UcBOm
InChI InChI=1S/C16H22O2/c1-3-4-8-14-13-9-6-5-7-12(13)10-11-15(14)16(17)18-2/h5-7,9,14-15H,3-4,8,10-11H2,1-2H3/t14-,15+/m1/s1
InChIKey SAQTXHCRQSAVEI-CABCVRRESA-N
Mol Weight 246.35 g/mol
Molecular Formula C16H22O2
Exact Mass 246.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9grbedMNQEJ
Name 2-Naphthalenecarboxylic acid, 1-butyl-1,2,3,4-tetrahydro-, methyl ester, cis-
Alternate Name(s) cis-1-n-butyl-2-carbomethoxy-1,2,3,4-tetrahydronaphthalene Methyl (1S,2S)-1-butyl-1,2,3,4-tetrahydro-2-naphthalenecarboxylate
CAS Registry Number 73331-56-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22O2
InChI InChI=1S/C16H22O2/c1-3-4-8-14-13-9-6-5-7-12(13)10-11-15(14)16(17)18-2/h5-7,9,14-15H,3-4,8,10-11H2,1-2H3/t14-,15+/m1/s1
InChIKey SAQTXHCRQSAVEI-CABCVRRESA-N
Molecular Weight 246.350 g/mol
SMILES [C@]1([C@@](C(=O)OC)(CCc2c1cccc2)[H])(CCCC)[H]
SPLASH splash10-004i-0900000000-16caf960af29cccdeccb
Source of Spectrum C-104-7619-0
Wiley ID 1249378