CID 48360

Benzylamine, n-(2-chloroethyl)-n-(2-(2-methoxyethoxy)ethyl)-, hydrochloride

Structural Information

Molecular Formula
C14H22ClNO2
SMILES
COCCOCCN(CCCl)CC1=CC=CC=C1
InChI
InChI=1S/C14H22ClNO2/c1-17-11-12-18-10-9-16(8-7-15)13-14-5-3-2-4-6-14/h2-6H,7-13H2,1H3
InChIKey
PCXDWBKGUORWSP-UHFFFAOYSA-N
Compound name
N-benzyl-N-(2-chloroethyl)-2-(2-methoxyethoxy)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

271.1339 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 272.14118 162.7
[M+Na]+ 294.12312 174.4
[M+NH4]+ 289.16772 170.9
[M+K]+ 310.09706 166.2
[M-H]- 270.12662 165.4
[M+Na-2H]- 292.10857 169.2
[M]+ 271.13335 165.4
[M]- 271.13445 165.4
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.

Patent stripe

No patent data available for this compound.