CID 56970312

4-bromopent-4-en-1-amine hydrochloride

Structural Information

Molecular Formula
C5H10BrN
SMILES
C=C(CCCN)Br
InChI
InChI=1S/C5H10BrN/c1-5(6)3-2-4-7/h1-4,7H2
InChIKey
WBZRFRTZKGKSBO-UHFFFAOYSA-N
Compound name
4-bromopent-4-en-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

162.99966 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.00694 129.2
[M+Na]+ 185.98888 139.4
[M-H]- 161.99238 131.8
[M+NH4]+ 181.03348 152.7
[M+K]+ 201.96282 128.7
[M+H-H2O]+ 145.99692 129.5
[M+HCOO]- 207.99786 150.2
[M+CH3COO]- 222.01351 179.0
[M+Na-2H]- 183.97433 135.6
[M]+ 162.99911 145.2
[M]- 163.00021 145.2
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

patents stripe