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1-cyclopentyl-3-[(1S,2S,5R)-2-isopropyl-5-methyl-cyclohexyl]thiourea
SpectraBase Compound ID FCWr9uPkqaB
InChI InChI=1S/C16H30N2S/c1-11(2)14-9-8-12(3)10-15(14)18-16(19)17-13-6-4-5-7-13/h11-15H,4-10H2,1-3H3,(H2,17,18,19)/t12-,14+,15+/m1/s1
InChIKey LTRXZXPLYSYUOK-SNPRPXQTSA-N
Mol Weight 282.49 g/mol
Molecular Formula C16H30N2S
Exact Mass 282.21297 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID X3bx7aL5YZ
Name 1-cyclopentyl-3-[(1S,2S,5R)-2-isopropyl-5-methyl-cyclohexyl]thiourea
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H30N2S
InChI InChI=1S/C16H30N2S/c1-11(2)14-9-8-12(3)10-15(14)18-16(19)17-13-6-4-5-7-13/h11-15H,4-10H2,1-3H3,(H2,17,18,19)/t12-,14+,15+/m1/s1
InChIKey LTRXZXPLYSYUOK-SNPRPXQTSA-N
Ionization Type EI
Molecular Weight 282.490 g/mol
SMILES N(C1CCCC1)C(=S)N[C@@]1([C@@](CC[C@](C1)(C)[H])(C(C)C)[H])[H]
SPLASH splash10-0002-9500000000-ec11e713c30b8bdd93a9
Source of Spectrum EP2135516B1
Wiley ID 1844995