CID 3066067

2-(1,1'-biphenyl)-4-yl-2-methylmorpholine hydrochloride

Structural Information

Molecular Formula
C17H19NO
SMILES
CC1(CNCCO1)C2=CC=C(C=C2)C3=CC=CC=C3
InChI
InChI=1S/C17H19NO/c1-17(13-18-11-12-19-17)16-9-7-15(8-10-16)14-5-3-2-4-6-14/h2-10,18H,11-13H2,1H3
InChIKey
PVDANCBLFQIQGE-UHFFFAOYSA-N
Compound name
2-methyl-2-(4-phenylphenyl)morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

253.14667 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 254.15395 160.3
[M+Na]+ 276.13589 165.5
[M-H]- 252.13939 167.1
[M+NH4]+ 271.18049 175.1
[M+K]+ 292.10983 161.6
[M+H-H2O]+ 236.14393 151.1
[M+HCOO]- 298.14487 177.2
[M+CH3COO]- 312.16052 170.9
[M+Na-2H]- 274.12134 166.6
[M]+ 253.14612 154.8
[M]- 253.14722 154.8
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

No patent data available for this compound.