CID 284897

2-(4-bromophenyl)-1-methylpyrrolidine

Structural Information

Molecular Formula
C11H14BrN
SMILES
CN1CCCC1C2=CC=C(C=C2)Br
InChI
InChI=1S/C11H14BrN/c1-13-8-2-3-11(13)9-4-6-10(12)7-5-9/h4-7,11H,2-3,8H2,1H3
InChIKey
RIEICTJOEICJJT-UHFFFAOYSA-N
Compound name
2-(4-bromophenyl)-1-methylpyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

169
Patents

239.03096 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 240.03824 150.2
[M+Na]+ 262.02018 153.7
[M+NH4]+ 257.06478 156.0
[M+K]+ 277.99412 153.7
[M-H]- 238.02368 152.4
[M+Na-2H]- 260.00563 154.1
[M]+ 239.03041 150.1
[M]- 239.03151 150.1
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

patents stripe