CID 63386709

(2-chloroethyl)(methyl)(prop-2-en-1-yl)amine hydrochloride

Structural Information

Molecular Formula
C6H12ClN
SMILES
CN(CCCl)CC=C
InChI
InChI=1S/C6H12ClN/c1-3-5-8(2)6-4-7/h3H,1,4-6H2,2H3
InChIKey
NQVHCGAZGCUYDB-UHFFFAOYSA-N
Compound name
N-(2-chloroethyl)-N-methylprop-2-en-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

133.06583 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 134.073106 127.6
[M+Na]+ 156.055048 135.2
[M-H]- 132.058554 129.1
[M+NH4]+ 151.099653 150.8
[M+K]+ 172.028988 133.5
[M+H-H2O]+ 116.063090 123.7
[M+HCOO]- 178.064031 148.5
[M+CH3COO]- 192.079681 178.6
[M+Na-2H]- 154.040496 133.7
[M]+ 133.06528142 130.4
[M]- 133.06637858 130.4
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.