CID 330448

1-benzhydrylazetidin-3-ol

Structural Information

Molecular Formula
C16H17NO
SMILES
C1C(CN1C(C2=CC=CC=C2)C3=CC=CC=C3)O
InChI
InChI=1S/C16H17NO/c18-15-11-17(12-15)16(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10,15-16,18H,11-12H2
InChIKey
MMAJXKGUZYDTHV-UHFFFAOYSA-N
Compound name
1-benzhydrylazetidin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

1870
Patents

239.13101 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 240.13829 152.4
[M+Na]+ 262.12023 162.3
[M+NH4]+ 257.16483 157.5
[M+K]+ 278.09417 156.7
[M-H]- 238.12373 155.1
[M+Na-2H]- 260.10568 160.1
[M]+ 239.13046 153.5
[M]- 239.13156 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