CID 5746314

Nsc 83069

Structural Information

Molecular Formula
C6H14ClN
SMILES
C[C@H]([C@@H](C)Cl)N(C)C
InChI
InChI=1S/C6H14ClN/c1-5(7)6(2)8(3)4/h5-6H,1-4H3/t5-,6-/m1/s1
InChIKey
BAPQFPNXQHWJBX-PHDIDXHHSA-N
Compound name
(2R,3R)-3-chloro-N,N-dimethylbutan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

135.08148 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 136.08876 128.0
[M+Na]+ 158.07070 138.7
[M+NH4]+ 153.11530 137.2
[M+K]+ 174.04464 133.4
[M-H]- 134.07420 128.9
[M+Na-2H]- 156.05615 132.6
[M]+ 135.08093 130.0
[M]- 135.08203 130.0
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

No patent data available for this compound.