CID 26538

2-mdp hydrochloride

Structural Information

Molecular Formula
C16H19NO
SMILES
CC(CN)C(C1=CC=CC=C1)(C2=CC=CC=C2)O
InChI
InChI=1S/C16H19NO/c1-13(12-17)16(18,14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2-11,13,18H,12,17H2,1H3
InChIKey
XGYCHIPEPHYUIH-UHFFFAOYSA-N
Compound name
3-amino-2-methyl-1,1-diphenylpropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

73
Patents

241.14667 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.15395 157.0
[M+Na]+ 264.13589 161.6
[M-H]- 240.13939 161.4
[M+NH4]+ 259.18049 172.8
[M+K]+ 280.10983 157.4
[M+H-H2O]+ 224.14393 149.9
[M+HCOO]- 286.14487 177.3
[M+CH3COO]- 300.16052 193.0
[M+Na-2H]- 262.12134 162.4
[M]+ 241.14612 153.5
[M]- 241.14722 153.5
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