CID 5007454

2-[(2-methoxyphenyl)methyl]pyrrolidine hydrochloride

Structural Information

Molecular Formula
C12H17NO
SMILES
COC1=CC=CC=C1CC2CCCN2
InChI
InChI=1S/C12H17NO/c1-14-12-7-3-2-5-10(12)9-11-6-4-8-13-11/h2-3,5,7,11,13H,4,6,8-9H2,1H3
InChIKey
UXGBCRSPJXTNMD-UHFFFAOYSA-N
Compound name
2-[(2-methoxyphenyl)methyl]pyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

191.13101 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.13829 144.6
[M+Na]+ 214.12023 156.3
[M+NH4]+ 209.16483 153.5
[M+K]+ 230.09417 150.9
[M-H]- 190.12373 147.7
[M+Na-2H]- 212.10568 151.4
[M]+ 191.13046 147.0
[M]- 191.13156 147.0
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