CID 66468485

2-methyl-2-[(naphthalen-1-yl)methyl]pyrrolidine hydrochloride

Structural Information

Molecular Formula
C16H19N
SMILES
CC1(CCCN1)CC2=CC=CC3=CC=CC=C32
InChI
InChI=1S/C16H19N/c1-16(10-5-11-17-16)12-14-8-4-7-13-6-2-3-9-15(13)14/h2-4,6-9,17H,5,10-12H2,1H3
InChIKey
GMZZUKMKNZTVAV-UHFFFAOYSA-N
Compound name
2-methyl-2-(naphthalen-1-ylmethyl)pyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

225.15175 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.159026 153.7
[M+Na]+ 248.140968 160.5
[M-H]- 224.144474 158.2
[M+NH4]+ 243.185573 174.4
[M+K]+ 264.114908 154.8
[M+H-H2O]+ 208.149010 146.2
[M+HCOO]- 270.149951 172.5
[M+CH3COO]- 284.165601 165.3
[M+Na-2H]- 246.126416 158.7
[M]+ 225.15120142 149.4
[M]- 225.15229858 149.4
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

No patent data available for this compound.