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1',4'-dihydro-2'-n-butyl-4-tert-butylspiro[cyclohexane-1,3'(2'H)-isoquinolin]-1'-one
SpectraBase Compound ID I2UjzrfAmx6
InChI InChI=1S/C22H33NO/c1-5-6-15-23-20(24)19-10-8-7-9-17(19)16-22(23)13-11-18(12-14-22)21(2,3)4/h7-10,18H,5-6,11-16H2,1-4H3
InChIKey KRBRNQMJEKSWHE-UHFFFAOYSA-N
Mol Weight 327.5 g/mol
Molecular Formula C22H33NO
Exact Mass 327.256215 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6X0oKnGR8AJ
Name 1',4'-dihydro-2'-n-butyl-4-tert-butylspiro[cyclohexane-1,3'(2'H)-isoquinolin]-1'-one
CAS Registry Number 120637-18-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H33NO
InChI InChI=1S/C22H33NO/c1-5-6-15-23-20(24)19-10-8-7-9-17(19)16-22(23)13-11-18(12-14-22)21(2,3)4/h7-10,18H,5-6,11-16H2,1-4H3
InChIKey KRBRNQMJEKSWHE-UHFFFAOYSA-N
Molecular Weight 327.512 g/mol
SMILES C1(N(C2(CCC(C(C)(C)C)CC2)Cc2c1cccc2)CCCC)=O
SPLASH splash10-004i-0192000000-c38fd0be5b8bd543aa7d
Source of Spectrum J-54-2995-6
Synonyms 2'-butyl-4-tert-butyl-2',4'-dihydro-1'H-spiro[cyclohexane-1,3'-isoquinoline]-1'-one
Wiley ID 1325761