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[2-Amino-4-(adamantyl-1)phenyl]cyclopropane
SpectraBase Compound ID FsPLQrWnvfB
InChI InChI=1S/C19H25N/c20-18-8-17(18)15-1-3-16(4-2-15)19-9-12-5-13(10-19)7-14(6-12)11-19/h1-4,12-14,17-18H,5-11,20H2/t12-,13+,14-,17?,18?,19-
InChIKey WQODPQVVCDBAJW-ADMZXBLGSA-N
Mol Weight 267.42 g/mol
Molecular Formula C19H25N
Exact Mass 267.1987 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 4430QQ4t0gR
Name [2-Amino-4-(adamantyl-1)phenyl]cyclopropane
Comments Computed using SmartSpectra Model v1.42
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Exact Mass 267.198699809 u
Formula C19H25N
InChI InChI=1S/C19H25N/c20-18-8-17(18)15-1-3-16(4-2-15)19-9-12-5-13(10-19)7-14(6-12)11-19/h1-4,12-14,17-18H,5-11,20H2/t12-,13+,14-,17?,18?,19-
InChIKey WQODPQVVCDBAJW-ADMZXBLGSA-N
Molecular Weight 267.416 g/mol
SMILES C1=C(C=CC(=C1)C1CC1N)C12C[C@]3(C[C@@](C2)(C[C@@](C1)(C3)[H])[H])[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.929818