CID 9794746

(s)-(-)-2-amino-3-methyl-1,1-diphenylbutane

Structural Information

Molecular Formula
C17H21N
SMILES
CC(C)[C@@H](C(C1=CC=CC=C1)C2=CC=CC=C2)N
InChI
InChI=1S/C17H21N/c1-13(2)17(18)16(14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-13,16-17H,18H2,1-2H3/t17-/m0/s1
InChIKey
KJRIVAFIKUXDBL-KRWDZBQOSA-N
Compound name
(2S)-3-methyl-1,1-diphenylbutan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

239.1674 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 240.17468 159.5
[M+Na]+ 262.15662 172.3
[M+NH4]+ 257.20122 168.7
[M+K]+ 278.13056 164.8
[M-H]- 238.16012 165.1
[M+Na-2H]- 260.14207 168.6
[M]+ 239.16685 163.0
[M]- 239.16795 163.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe