CID 121553333

(1-bromocyclopropyl)methanamine

Structural Information

Molecular Formula
C4H8BrN
SMILES
C1CC1(CN)Br
InChI
InChI=1S/C4H8BrN/c5-4(3-6)1-2-4/h1-3,6H2
InChIKey
GVHUQXUEDCFNFO-UHFFFAOYSA-N
Compound name
(1-bromocyclopropyl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

148.98401 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 149.99129 122.7
[M+Na]+ 171.97323 135.9
[M-H]- 147.97673 130.0
[M+NH4]+ 167.01783 144.1
[M+K]+ 187.94717 125.8
[M+H-H2O]+ 131.98127 123.6
[M+HCOO]- 193.98221 145.1
[M+CH3COO]- 207.99786 178.0
[M+Na-2H]- 169.95868 132.6
[M]+ 148.98346 140.9
[M]- 148.98456 140.9
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

patents stripe