CID 102482

761-21-7

Structural Information

Molecular Formula
C7H16ClN
SMILES
CCN(CC)CC(C)Cl
InChI
InChI=1S/C7H16ClN/c1-4-9(5-2)6-7(3)8/h7H,4-6H2,1-3H3
InChIKey
QOHJWGXVMZSTAZ-UHFFFAOYSA-N
Compound name
2-chloro-N,N-diethylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

55
Patents

149.09712 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 150.10440 132.1
[M+Na]+ 172.08634 142.8
[M+NH4]+ 167.13094 141.2
[M+K]+ 188.06028 136.5
[M-H]- 148.08984 133.1
[M+Na-2H]- 170.07179 136.7
[M]+ 149.09657 134.1
[M]- 149.09767 134.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

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