CID 702733

(r)-(+)-2-amino-3-methyl-1,1-diphenyl-1-butanol

Structural Information

Molecular Formula
C17H21NO
SMILES
CC(C)[C@H](C(C1=CC=CC=C1)(C2=CC=CC=C2)O)N
InChI
InChI=1S/C17H21NO/c1-13(2)16(18)17(19,14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-13,16,19H,18H2,1-2H3/t16-/m1/s1
InChIKey
LNQVZZGGOZBOQS-MRXNPFEDSA-N
Compound name
(2R)-2-amino-3-methyl-1,1-diphenylbutan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

208
Patents

255.16231 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.16959 162.7
[M+Na]+ 278.15153 174.5
[M+NH4]+ 273.19613 170.9
[M+K]+ 294.12547 168.3
[M-H]- 254.15503 166.8
[M+Na-2H]- 276.13698 171.1
[M]+ 255.16176 165.6
[M]- 255.16286 165.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe