CID 10976324

2-(bromomethyl)-1-(2-methylpropyl)aziridine

Structural Information

Molecular Formula
C7H14BrN
SMILES
CC(C)CN1CC1CBr
InChI
InChI=1S/C7H14BrN/c1-6(2)4-9-5-7(9)3-8/h6-7H,3-5H2,1-2H3
InChIKey
JMBBTMPWVWSGOY-UHFFFAOYSA-N
Compound name
2-(bromomethyl)-1-(2-methylpropyl)aziridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

191.03096 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.03824 138.7
[M+Na]+ 214.02018 151.7
[M-H]- 190.02368 144.8
[M+NH4]+ 209.06478 156.6
[M+K]+ 229.99412 140.8
[M+H-H2O]+ 174.02822 137.9
[M+HCOO]- 236.02916 158.3
[M+CH3COO]- 250.04481 187.0
[M+Na-2H]- 212.00563 144.9
[M]+ 191.03041 159.2
[M]- 191.03151 159.2
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.