CID 54593084

(1-methyl-2-phenylpyrrolidin-3-yl)methanamine dihydrochloride

Structural Information

Molecular Formula
C12H18N2
SMILES
CN1CCC(C1C2=CC=CC=C2)CN
InChI
InChI=1S/C12H18N2/c1-14-8-7-11(9-13)12(14)10-5-3-2-4-6-10/h2-6,11-12H,7-9,13H2,1H3
InChIKey
ARLUXCWBAJJHBT-UHFFFAOYSA-N
Compound name
(1-methyl-2-phenylpyrrolidin-3-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

190.147 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.15428 144.5
[M+Na]+ 213.13622 156.0
[M+NH4]+ 208.18082 153.6
[M+K]+ 229.11016 150.6
[M-H]- 189.13972 148.7
[M+Na-2H]- 211.12167 151.4
[M]+ 190.14645 147.2
[M]- 190.14755 147.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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No literature data available for this compound.

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No patent data available for this compound.