CID 15429065

3-(3-methoxyphenyl)-3-methylpyrrolidine hydrochloride

Structural Information

Molecular Formula
C12H17NO
SMILES
CC1(CCNC1)C2=CC(=CC=C2)OC
InChI
InChI=1S/C12H17NO/c1-12(6-7-13-9-12)10-4-3-5-11(8-10)14-2/h3-5,8,13H,6-7,9H2,1-2H3
InChIKey
FRUJQSYHJKSUMV-UHFFFAOYSA-N
Compound name
3-(3-methoxyphenyl)-3-methylpyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

191.13101 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.13829 144.3
[M+Na]+ 214.12023 156.1
[M+NH4]+ 209.16483 154.6
[M+K]+ 230.09417 149.1
[M-H]- 190.12373 147.3
[M+Na-2H]- 212.10568 152.6
[M]+ 191.13046 146.9
[M]- 191.13156 146.9
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