CID 191086

30275-30-0

Structural Information

Molecular Formula
C15H17N
SMILES
CC1=CC=C(C=C1)CC(C2=CC=CC=C2)N
InChI
InChI=1S/C15H17N/c1-12-7-9-13(10-8-12)11-15(16)14-5-3-2-4-6-14/h2-10,15H,11,16H2,1H3
InChIKey
ZICDZTXDTPZBKH-UHFFFAOYSA-N
Compound name
2-(4-methylphenyl)-1-phenylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

484
Patents

211.1361 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.14338 149.9
[M+Na]+ 234.12532 164.2
[M+NH4]+ 229.16992 159.7
[M+K]+ 250.09926 155.8
[M-H]- 210.12882 156.0
[M+Na-2H]- 232.11077 160.1
[M]+ 211.13555 153.8
[M]- 211.13665 153.8
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