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]+ 134.07311 127.6
[M+Na]+ 156.05505 135.2
[M-H]- 132.05855 129.1
[M+NH4]+ 151.09965 150.8
[M+K]+ 172.02899 133.5
[M+H-H2O]+ 116.06309 123.7
[M+HCOO]- 178.06403 148.5
[M+CH3COO]- 192.07968 178.6
[M+Na-2H]- 154.04050 133.7
[M]+ 133.06528 130.4
[M]- 133.06638 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.