CID 640792

1-chloro-n,n-2-trimethylpropenylamine

Structural Information

Molecular Formula
C6H12ClN
SMILES
CC(=C(N(C)C)Cl)C
InChI
InChI=1S/C6H12ClN/c1-5(2)6(7)8(3)4/h1-4H3
InChIKey
GQIRIWDEZSKOCN-UHFFFAOYSA-N
Compound name
1-chloro-N,N,2-trimethylprop-1-en-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

5435
Patents

133.06583 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 134.07311 127.7
[M+Na]+ 156.05505 134.9
[M-H]- 132.05855 129.6
[M+NH4]+ 151.09965 151.0
[M+K]+ 172.02899 134.1
[M+H-H2O]+ 116.06309 124.1
[M+HCOO]- 178.06403 146.7
[M+CH3COO]- 192.07968 179.6
[M+Na-2H]- 154.04050 131.3
[M]+ 133.06528 129.2
[M]- 133.06638 129.2
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.